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Nitrogen mustard compounds

Nitrogen mustard compounds

Nitrogen mustards are cytotoxic organic compounds with the chloroethylamine functional group, which consists of the following structure: Cl(CH2)2NR2, where R can be any organic group. They are nitrogen analogs of mustard gas.
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1 – 15 of 89 results
1

N-Methyl-bis(trifluoroacetamide), ≥97.0% (GC), MilliporeSigma™ Supelco™

MDL Number: MFCD00000412 Synonym: MBTFA (N-methyl-bis(trifluoroacetamide)or BTFA (bis(TFA)); MBTFA

MDL Number MFCD00000412
Synonym MBTFA (N-methyl-bis(trifluoroacetamide)or BTFA (bis(TFA)); MBTFA
2

Bendamustine hydrochloride, Tocris Bioscience™
GREENER_CHOICE

CAS: 3543-75-7 Molecular Formula: C16H22Cl3N3O2 Molecular Weight (g/mol): 394.721 InChI Key: ZHSKUOZOLHMKEA-UHFFFAOYSA-N Synonym: bendamustine hydrochloride,treanda,bendamustine hcl,ribomustin,cytostasan,bendamustin hydrochloride,treakisym,4-5-bis 2-chloroethyl amino-1-methyl-1h-benzo d imidazol-2-yl butanoic acid hydrochloride,bendeka PubChem CID: 77082 IUPAC Name: 4-[5-[bis(2-chloroethyl)amino]-1-methylbenzimidazol-2-yl]butanoic acid;hydrochloride SMILES: CN1C2=C(C=C(C=C2)N(CCCl)CCCl)N=C1CCCC(=O)O.Cl

PubChem CID 77082
CAS 3543-75-7
Molecular Weight (g/mol) 394.721
SMILES CN1C2=C(C=C(C=C2)N(CCCl)CCCl)N=C1CCCC(=O)O.Cl
Synonym bendamustine hydrochloride,treanda,bendamustine hcl,ribomustin,cytostasan,bendamustin hydrochloride,treakisym,4-5-bis 2-chloroethyl amino-1-methyl-1h-benzo d imidazol-2-yl butanoic acid hydrochloride,bendeka
IUPAC Name 4-[5-[bis(2-chloroethyl)amino]-1-methylbenzimidazol-2-yl]butanoic acid;hydrochloride
InChI Key ZHSKUOZOLHMKEA-UHFFFAOYSA-N
Molecular Formula C16H22Cl3N3O2
3

N,N-Bis(2-chloroethyl)carbamoyl Chloride 97.0+%, TCI America™
SDP

CAS: 2998-56-3 Molecular Formula: C5H8Cl3NO Molecular Weight (g/mol): 204.48 MDL Number: MFCD00144974 InChI Key: JAHXVUPWHXMPLG-UHFFFAOYSA-N PubChem CID: 76346 IUPAC Name: N,N-bis(2-chloroethyl)carbamoyl chloride SMILES: ClCCN(CCCl)C(Cl)=O

PubChem CID 76346
CAS 2998-56-3
Molecular Weight (g/mol) 204.48
MDL Number MFCD00144974
SMILES ClCCN(CCCl)C(Cl)=O
IUPAC Name N,N-bis(2-chloroethyl)carbamoyl chloride
InChI Key JAHXVUPWHXMPLG-UHFFFAOYSA-N
Molecular Formula C5H8Cl3NO
4

N-Methylbis(trifluoroacetamide) 97.0+%, TCI America™
SDP

CAS: 685-27-8 Molecular Formula: C5H3F6NO2 Molecular Weight (g/mol): 223.074 MDL Number: MFCD00000412 InChI Key: AWGBWLXGUPTXHF-UHFFFAOYSA-N Synonym: mbtfa,n-methyl-bis trifluoroacetamide,n-methylbis trifluoroacetamide,2,2,2-trifluoro-n-methyl-n-trifluoroacetyl acetamide,n,n-bis trifluoroacetyl methylamine,2,2,2-trifluoro-n-methyl-n-2,2,2-trifluoroacetyl acetamide,acetamide, 2,2,2-trifluoro-n-methyl-n-trifluoroacetyl,n-methylbistrifluoroacetamide,n-methyl-bis-trifluoroacetamide PubChem CID: 69635 IUPAC Name: 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide SMILES: CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F

PubChem CID 69635
CAS 685-27-8
Molecular Weight (g/mol) 223.074
MDL Number MFCD00000412
SMILES CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F
Synonym mbtfa,n-methyl-bis trifluoroacetamide,n-methylbis trifluoroacetamide,2,2,2-trifluoro-n-methyl-n-trifluoroacetyl acetamide,n,n-bis trifluoroacetyl methylamine,2,2,2-trifluoro-n-methyl-n-2,2,2-trifluoroacetyl acetamide,acetamide, 2,2,2-trifluoro-n-methyl-n-trifluoroacetyl,n-methylbistrifluoroacetamide,n-methyl-bis-trifluoroacetamide
IUPAC Name 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide
InChI Key AWGBWLXGUPTXHF-UHFFFAOYSA-N
Molecular Formula C5H3F6NO2
5

Bis(2-chloroethyl)amine hydrochloride, 98%, Thermo Scientific Chemicals

CAS: 821-48-7 Molecular Formula: C4H10Cl3N Molecular Weight (g/mol): 178.481 MDL Number: MFCD00012515 InChI Key: YMDZDFSUDFLGMX-UHFFFAOYSA-N Synonym: bis 2-chloroethyl amine hydrochloride,2,2'-dichlorodiethylamine hydrochloride,2-chloro-n-2-chloroethyl ethanamine hydrochloride,nor-lost hydrochlorid,nor-hn2,ethanamine, 2-chloro-n-2-chloroethyl-, hydrochloride,n,n-bis 2-chloroethyl amine hydrochloride,di-2-chloroethyl amine hydrochloride,2,2-dichlorodiethylamine hydrochloride,bis-2-chloroethyl amine hydrochloride PubChem CID: 522769 IUPAC Name: 2-chloro-N-(2-chloroethyl)ethanamine;hydrochloride SMILES: C(CCl)NCCCl.Cl

PubChem CID 522769
CAS 821-48-7
Molecular Weight (g/mol) 178.481
MDL Number MFCD00012515
SMILES C(CCl)NCCCl.Cl
Synonym bis 2-chloroethyl amine hydrochloride,2,2'-dichlorodiethylamine hydrochloride,2-chloro-n-2-chloroethyl ethanamine hydrochloride,nor-lost hydrochlorid,nor-hn2,ethanamine, 2-chloro-n-2-chloroethyl-, hydrochloride,n,n-bis 2-chloroethyl amine hydrochloride,di-2-chloroethyl amine hydrochloride,2,2-dichlorodiethylamine hydrochloride,bis-2-chloroethyl amine hydrochloride
IUPAC Name 2-chloro-N-(2-chloroethyl)ethanamine;hydrochloride
InChI Key YMDZDFSUDFLGMX-UHFFFAOYSA-N
Molecular Formula C4H10Cl3N
6

Bis(2,2,2-trifluoroethyl)amine, 95%, Thermo Scientific Chemicals

CAS: 407-01-2 Molecular Formula: C4H5F6N Molecular Weight (g/mol): 181.081 MDL Number: MFCD00042094 InChI Key: GTJGHXLFPMOKCE-UHFFFAOYSA-N PubChem CID: 78999 IUPAC Name: 2,2,2-trifluoro-N-(2,2,2-trifluoroethyl)ethanamine SMILES: C(C(F)(F)F)NCC(F)(F)F

PubChem CID 78999
CAS 407-01-2
Molecular Weight (g/mol) 181.081
MDL Number MFCD00042094
SMILES C(C(F)(F)F)NCC(F)(F)F
IUPAC Name 2,2,2-trifluoro-N-(2,2,2-trifluoroethyl)ethanamine
InChI Key GTJGHXLFPMOKCE-UHFFFAOYSA-N
Molecular Formula C4H5F6N
7

N-methyl-bis(trifluoroacetamide), 98%, Thermo Scientific Chemicals

CAS: 685-27-8 Molecular Formula: C5H3F6NO2 Molecular Weight (g/mol): 223.07 InChI Key: AWGBWLXGUPTXHF-UHFFFAOYSA-N Synonym: mbtfa,n-methyl-bis trifluoroacetamide,n-methylbis trifluoroacetamide,2,2,2-trifluoro-n-methyl-n-trifluoroacetyl acetamide,n,n-bis trifluoroacetyl methylamine,2,2,2-trifluoro-n-methyl-n-2,2,2-trifluoroacetyl acetamide,acetamide, 2,2,2-trifluoro-n-methyl-n-trifluoroacetyl,n-methylbistrifluoroacetamide,n-methyl-bis-trifluoroacetamide PubChem CID: 69635 IUPAC Name: 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide SMILES: CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F

PubChem CID 69635
CAS 685-27-8
Molecular Weight (g/mol) 223.07
SMILES CN(C(=O)C(F)(F)F)C(=O)C(F)(F)F
Synonym mbtfa,n-methyl-bis trifluoroacetamide,n-methylbis trifluoroacetamide,2,2,2-trifluoro-n-methyl-n-trifluoroacetyl acetamide,n,n-bis trifluoroacetyl methylamine,2,2,2-trifluoro-n-methyl-n-2,2,2-trifluoroacetyl acetamide,acetamide, 2,2,2-trifluoro-n-methyl-n-trifluoroacetyl,n-methylbistrifluoroacetamide,n-methyl-bis-trifluoroacetamide
IUPAC Name 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide
InChI Key AWGBWLXGUPTXHF-UHFFFAOYSA-N
Molecular Formula C5H3F6NO2
8

Cyclophosphamide Monohydrate 98.0+%, TCI America™
SDP

CAS: 6055-19-2 Molecular Formula: C7H17Cl2N2O3P Molecular Weight (g/mol): 279.10 MDL Number: MFCD00149395 InChI Key: PWOQRKCAHTVFLB-UHFFFAOYNA-N Synonym: cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated PubChem CID: 22420 ChEBI: CHEBI:4026 IUPAC Name: 2-[bis(2-chloroethyl)amino]-1,3,2λ⁵-oxazaphosphinan-2-one hydrate SMILES: O.ClCCN(CCCl)P1(=O)NCCCO1

PubChem CID 22420
CAS 6055-19-2
Molecular Weight (g/mol) 279.10
ChEBI CHEBI:4026
MDL Number MFCD00149395
SMILES O.ClCCN(CCCl)P1(=O)NCCCO1
Synonym cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated
IUPAC Name 2-[bis(2-chloroethyl)amino]-1,3,2λ⁵-oxazaphosphinan-2-one hydrate
InChI Key PWOQRKCAHTVFLB-UHFFFAOYNA-N
Molecular Formula C7H17Cl2N2O3P
9

Bistrifluoroacetamide 98.0+%, TCI America™
SDP

CAS: 407-24-9 Molecular Formula: C4HF6NO2 Molecular Weight (g/mol): 209.05 MDL Number: MFCD00013564 InChI Key: GMQVFHZSXKJCIV-UHFFFAOYSA-N Synonym: BTFA PubChem CID: 67885 IUPAC Name: 2,2,2-trifluoro-N-(2,2,2-trifluoroacetyl)acetamide SMILES: FC(F)(F)C(=O)NC(=O)C(F)(F)F

PubChem CID 67885
CAS 407-24-9
Molecular Weight (g/mol) 209.05
MDL Number MFCD00013564
SMILES FC(F)(F)C(=O)NC(=O)C(F)(F)F
Synonym BTFA
IUPAC Name 2,2,2-trifluoro-N-(2,2,2-trifluoroacetyl)acetamide
InChI Key GMQVFHZSXKJCIV-UHFFFAOYSA-N
Molecular Formula C4HF6NO2
10

Perfluorotributylamine, MP Biomedicals

CAS: 311-89-7 Molecular Formula: C12F27N Molecular Weight (g/mol): 671.096 InChI Key: RVZRBWKZFJCCIB-UHFFFAOYSA-N Synonym: perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine PubChem CID: 9397 ChEBI: CHEBI:38854 IUPAC Name: 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine SMILES: C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

PubChem CID 9397
CAS 311-89-7
Molecular Weight (g/mol) 671.096
ChEBI CHEBI:38854
SMILES C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Synonym perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine
IUPAC Name 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine
InChI Key RVZRBWKZFJCCIB-UHFFFAOYSA-N
Molecular Formula C12F27N
11

Cyclophosphamide, 99.5%, MP Biomedicals™

CAS: 6055-19-2 Molecular Formula: C7H17Cl2N2O3P Molecular Weight (g/mol): 279.10 MDL Number: MFCD00149395 InChI Key: PWOQRKCAHTVFLB-UHFFFAOYNA-N Synonym: cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated PubChem CID: 22420 ChEBI: CHEBI:4026 IUPAC Name: 2-[bis(2-chloroethyl)amino]-1,3,2λ⁵-oxazaphosphinan-2-one hydrate SMILES: O.ClCCN(CCCl)P1(=O)NCCCO1

PubChem CID 22420
CAS 6055-19-2
Molecular Weight (g/mol) 279.10
ChEBI CHEBI:4026
MDL Number MFCD00149395
SMILES O.ClCCN(CCCl)P1(=O)NCCCO1
Synonym cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated
IUPAC Name 2-[bis(2-chloroethyl)amino]-1,3,2λ⁵-oxazaphosphinan-2-one hydrate
InChI Key PWOQRKCAHTVFLB-UHFFFAOYNA-N
Molecular Formula C7H17Cl2N2O3P
12

Cyclophosphamide Monohydrate, MP Biomedicals

CAS: 6055-19-2 Molecular Formula: C7H17Cl2N2O3P Molecular Weight (g/mol): 279.10 MDL Number: MFCD00149395 InChI Key: PWOQRKCAHTVFLB-UHFFFAOYNA-N Synonym: cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated PubChem CID: 22420 ChEBI: CHEBI:4026 IUPAC Name: 2-[bis(2-chloroethyl)amino]-1,3,2λ⁵-oxazaphosphinan-2-one hydrate SMILES: O.ClCCN(CCCl)P1(=O)NCCCO1

PubChem CID 22420
CAS 6055-19-2
Molecular Weight (g/mol) 279.10
ChEBI CHEBI:4026
MDL Number MFCD00149395
SMILES O.ClCCN(CCCl)P1(=O)NCCCO1
Synonym cyclophosphamide monohydrate,cyclophosphamide hydrate,cytoxan,endoxon,endoxan monohydrate,ciclophosphamide hydrat,cytoxan hydrate,endoxan a,cyclophosphamide hydrated
IUPAC Name 2-[bis(2-chloroethyl)amino]-1,3,2λ⁵-oxazaphosphinan-2-one hydrate
InChI Key PWOQRKCAHTVFLB-UHFFFAOYNA-N
Molecular Formula C7H17Cl2N2O3P
13

3,4-Dibromomaleimide 98.0+%, TCI America™
SDP

CAS: 1122-10-7 Molecular Formula: C4HBr2NO2 Molecular Weight (g/mol): 254.865 MDL Number: MFCD00185696 InChI Key: BIKSKRPHKQWJCW-UHFFFAOYSA-N PubChem CID: 14279 IUPAC Name: 3,4-dibromopyrrole-2,5-dione SMILES: C1(=C(C(=O)NC1=O)Br)Br

PubChem CID 14279
CAS 1122-10-7
Molecular Weight (g/mol) 254.865
MDL Number MFCD00185696
SMILES C1(=C(C(=O)NC1=O)Br)Br
IUPAC Name 3,4-dibromopyrrole-2,5-dione
InChI Key BIKSKRPHKQWJCW-UHFFFAOYSA-N
Molecular Formula C4HBr2NO2
14

Heptacosafluorotributylamine 60.0+%, TCI America™
SDP

CAS: 311-89-7 Molecular Formula: C12F27N Molecular Weight (g/mol): 671.096 MDL Number: MFCD00000436 InChI Key: RVZRBWKZFJCCIB-UHFFFAOYSA-N Synonym: perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine PubChem CID: 9397 ChEBI: CHEBI:38854 IUPAC Name: 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine SMILES: C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

PubChem CID 9397
CAS 311-89-7
Molecular Weight (g/mol) 671.096
ChEBI CHEBI:38854
MDL Number MFCD00000436
SMILES C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Synonym perfluorotributylamine,tris perfluorobutyl amine,tri perfluorobutyl amine,tris nonafluorobutyl amine,heptacosafluorotributylamine,fluorinert,fluosol 43,perfluorotri-n-butylamine,fluorocarbon fc 43,tri nonafluorobutyl amine
IUPAC Name 1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)butan-1-amine
InChI Key RVZRBWKZFJCCIB-UHFFFAOYSA-N
Molecular Formula C12F27N
15

Perfluorotriamylamine (so called), TCI America™
SDP

CAS: 338-84-1 Molecular Formula: C15F33N Molecular Weight (g/mol): 821.119 MDL Number: MFCD00042367 InChI Key: AQZYBQIAUSKCCS-UHFFFAOYSA-N Synonym: perfluorotripentylamine,tris undecafluoropentyl amine,perfluorotri-n-pentylamine,perfluorotriamylamine,fluorinert fc-70,perfluoro-compound fc-70,1-pentanamine, 1,1,2,2,3,3,4,4,5,5,5-undecafluoro-n,n-bis undecafluoropentyl,1,1,2,2,3,3,4,4,5,5,5-undecafluoro-n,n-bis 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl pentan-1-amine,1-pentanamine, 1,1,2,2,3,3,4,4,5,5,5-undecafluoro-n,n-bis 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl,fluorinert fc 70 PubChem CID: 67646 IUPAC Name: 1,1,2,2,3,3,4,4,5,5,5-undecafluoro-N,N-bis(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)pentan-1-amine SMILES: C(C(C(N(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F

PubChem CID 67646
CAS 338-84-1
Molecular Weight (g/mol) 821.119
MDL Number MFCD00042367
SMILES C(C(C(N(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F
Synonym perfluorotripentylamine,tris undecafluoropentyl amine,perfluorotri-n-pentylamine,perfluorotriamylamine,fluorinert fc-70,perfluoro-compound fc-70,1-pentanamine, 1,1,2,2,3,3,4,4,5,5,5-undecafluoro-n,n-bis undecafluoropentyl,1,1,2,2,3,3,4,4,5,5,5-undecafluoro-n,n-bis 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl pentan-1-amine,1-pentanamine, 1,1,2,2,3,3,4,4,5,5,5-undecafluoro-n,n-bis 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl,fluorinert fc 70
IUPAC Name 1,1,2,2,3,3,4,4,5,5,5-undecafluoro-N,N-bis(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)pentan-1-amine
InChI Key AQZYBQIAUSKCCS-UHFFFAOYSA-N
Molecular Formula C15F33N