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Trifluoromethylbenzenes

Trifluoromethylbenzenes

Organic compounds that consist of a phenyl group bonded to a carbon that is bonded to three fluorine atoms in the following structure: C6H5CF3; also known as benzotrifluoride.
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1

(S)-(-)-Bay K 8644, Tocris Bioscience™
GREENER_CHOICE

CAS: 98625-26-4 Molecular Formula: C16H15F3N2O4 Molecular Weight (g/mol): 356.301 InChI Key: ZFLWDHHVRRZMEI-ZDUSSCGKSA-N PubChem CID: 6603728 IUPAC Name: methyl (4S)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate SMILES: CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC

PubChem CID 6603728
CAS 98625-26-4
Molecular Weight (g/mol) 356.301
SMILES CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC
IUPAC Name methyl (4S)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate
InChI Key ZFLWDHHVRRZMEI-ZDUSSCGKSA-N
Molecular Formula C16H15F3N2O4
2

(±)-Bay K 8644, Tocris Bioscience™
GSA_VA GREENER_CHOICE

CAS: 71145-03-4 Molecular Formula: C16H15F3N2O4 Molecular Weight (g/mol): 356.301 InChI Key: ZFLWDHHVRRZMEI-UHFFFAOYSA-N Synonym: methyl 2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-1,4-dihydropyridine-3-carboxylate,3-pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-, methyl ester,1,4-dihydro-2,6-dimethyl-5-nitro-4-2′-trifluoromethyl phenyl-3-pyridinecarboxylic acid methyl ester,bay-k-8644, +--isomer,opera_id_789,d01rad,y-bay k 8644,r-+-1,4-dihydro-2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-3-pyridinecarboxylic acid methyl ester PubChem CID: 2303 ChEBI: CHEBI:34555 IUPAC Name: methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate SMILES: CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC

PubChem CID 2303
CAS 71145-03-4
Molecular Weight (g/mol) 356.301
ChEBI CHEBI:34555
SMILES CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC
Synonym methyl 2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-1,4-dihydropyridine-3-carboxylate,3-pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-, methyl ester,1,4-dihydro-2,6-dimethyl-5-nitro-4-2′-trifluoromethyl phenyl-3-pyridinecarboxylic acid methyl ester,bay-k-8644, +--isomer,opera_id_789,d01rad,y-bay k 8644,r-+-1,4-dihydro-2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-3-pyridinecarboxylic acid methyl ester
IUPAC Name methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate
InChI Key ZFLWDHHVRRZMEI-UHFFFAOYSA-N
Molecular Formula C16H15F3N2O4
3

(±)-Bay K 8644, Thermo Scientific Chemicals

CAS: 71145-03-4 Molecular Formula: C16H15F3N2O4 Molecular Weight (g/mol): 356.301 MDL Number: MFCD00036697 InChI Key: ZFLWDHHVRRZMEI-UHFFFAOYSA-N Synonym: methyl 2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-1,4-dihydropyridine-3-carboxylate,3-pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-, methyl ester,1,4-dihydro-2,6-dimethyl-5-nitro-4-2′-trifluoromethyl phenyl-3-pyridinecarboxylic acid methyl ester,bay-k-8644, +--isomer,opera_id_789,d01rad,y-bay k 8644,r-+-1,4-dihydro-2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-3-pyridinecarboxylic acid methyl ester PubChem CID: 2303 ChEBI: CHEBI:34555 IUPAC Name: methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate SMILES: CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC

PubChem CID 2303
CAS 71145-03-4
Molecular Weight (g/mol) 356.301
ChEBI CHEBI:34555
MDL Number MFCD00036697
SMILES CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC
Synonym methyl 2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-1,4-dihydropyridine-3-carboxylate,3-pyridinecarboxylic acid, 1,4-dihydro-2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-, methyl ester,1,4-dihydro-2,6-dimethyl-5-nitro-4-2′-trifluoromethyl phenyl-3-pyridinecarboxylic acid methyl ester,bay-k-8644, +--isomer,opera_id_789,d01rad,y-bay k 8644,r-+-1,4-dihydro-2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-3-pyridinecarboxylic acid methyl ester
IUPAC Name methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate
InChI Key ZFLWDHHVRRZMEI-UHFFFAOYSA-N
Molecular Formula C16H15F3N2O4
4

(R)-(+)-Bay K 8644, Tocris Bioscience™
GREENER_CHOICE

CAS: 98791-67-4 Molecular Formula: C16H15F3N2O4 Molecular Weight (g/mol): 356.301 InChI Key: ZFLWDHHVRRZMEI-CYBMUJFWSA-N Synonym: r-+-bay k 8644,bay-k-8644 r-+-,methyl 4r-2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-1,4-dihydropyridine-3-carboxylate,bay-k-8644 r-+,tocris-1546,bidd:pxr0106,r-bayk8644,r-bay k8644,r-bay-k-8644,r + bay k 8644 PubChem CID: 6604881 IUPAC Name: methyl (4R)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate SMILES: CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC

PubChem CID 6604881
CAS 98791-67-4
Molecular Weight (g/mol) 356.301
SMILES CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC
Synonym r-+-bay k 8644,bay-k-8644 r-+-,methyl 4r-2,6-dimethyl-5-nitro-4-2-trifluoromethyl phenyl-1,4-dihydropyridine-3-carboxylate,bay-k-8644 r-+,tocris-1546,bidd:pxr0106,r-bayk8644,r-bay k8644,r-bay-k-8644,r + bay k 8644
IUPAC Name methyl (4R)-2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate
InChI Key ZFLWDHHVRRZMEI-CYBMUJFWSA-N
Molecular Formula C16H15F3N2O4