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Caffeine, citrated, Thermo Scientific Chemicals

Catalog No. AC461721000
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Caffeine, citrated, ACROS Organics, Quantity: 100g, Melting Point: 159.0 deg.C to 161.0 deg.C, Molecular Weight: 386.31, CAS: 69-22-7, Formula Weight: 386.31, Health Hazard 1: GHS Signal Word: Warning, Health Hazard 2: GHS H Statement Harmful if swallowed. Causes serious eye irritation.

This Thermo Scientific Chemicals brand product was originally part of the Acros Organics product portfolio. Some documentation and label information may refer to the legacy brand. The original Acros Organics product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Chemical Identifiers

CAS

69-22-7

Molecular Formula

C14H18N4O9

Molecular Weight (g/mol)

386.32

MDL Number

MFCD00044986

InChI Key

RCQXSQPPHJPGOF-UHFFFAOYSA-N

Synonym

caffeine citrate, caffeine, citrated, caffeina citrate, citrated caffein, caffeine citrate 1:1, caffeine citrated, unii-u26eo4675q, citric acid, compd. with caffeine 1:1, 1,2,3-propanetricarboxylic acid, 2-hydroxy-, mixt. with 3,7-dihydro-1,3,7-trimethyl-1h-purine-2,6-dione, dsstox_cid_26938

PubChem CID

6241

IUPAC Name

2-hydroxypropane-1,2,3-tricarboxylic acid;1,3,7-trimethylpurine-2,6-dione

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.CN1C=NC2=C1C(=O)N(C)C(=O)N2C

Specifications

Melting Point

159.0°C to 161.0°C

Quantity

100 g

Solubility Information

Solubility in water: .. Other solubilities: slightly soluble in dmso and methanol

Formula Weight

386.31

Chemical Name or Material

Caffeine, citrated

Hazard Category

GHS Signal Word: Warning

Hazard Statement

GHS H Statement
Harmful if swallowed.
Causes serious eye irritation.

Precautionary Statement

GHS P Statement
IF SWALLOWED: rinse mouth.
Do NOT induce vomiting.
Call a POISON CENTER or doctor/physician if you feel unwell.
Wash face,hands and any exposed skin thoroughly after handling.
SDS

RUO – Research Use Only

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