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Theobromine, 99%

Catalog No. p-7052397
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AAA1186118 50 g
AAA1186122 100 g
AAA1186130 250 g
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Catalog No. AAA1186118 Supplier Thermo Scientific Chemicals Supplier No. A1186118
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Description

Phosphodiesterase inhibitor | CAS: 83-67-0 | C7H8N4O2 | 180.167 g/mol

Phosphodiesterase inhibitor, weak adenosine receptor antagonist, diuretic and smooth muscle relaxant.

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

Applications
Phosphodiesterase inhibitor, weak adenosine receptor antagonist, diuretic and smooth muscle relaxant.

Solubility
Soluble in hot methanol and dimethyl sulfoxide.

Notes
Store in cool, dry conditions in well sealed container. Store away from oxidizing agent. Store away from strong bases.

Chemical Identifiers

CAS 83-67-0
Molecular Formula C7H8N4O2
Molecular Weight (g/mol) 180.167
MDL Number MFCD00022830
InChI Key YAPQBXQYLJRXSA-UHFFFAOYSA-N
Synonym theobromine, 3,7-dimethylxanthine, diurobromine, teobromin, theosalvose, theostene, santheose, thesodate, thesal, theobromin
PubChem CID 5429
ChEBI CHEBI:28946
IUPAC Name 3,7-dimethylpurine-2,6-dione
SMILES CN1C=NC2=C1C(=O)NC(=O)N2C

Specifications

Melting Point 345°C to 350°C
Color White
Density 1.50 g/mL
Quantity 50 g
Beilstein 16464
Merck Index 14,9282
Solubility Information Soluble in hot methanol and dimethyl sulfoxide.
Formula Weight 180.17
Percent Purity 99%
Physical Form Powder
Chemical Name or Material Theobromine
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Safety and Handling

Hazard Category H302
Hazard Statement GHS H Statement
H301
Toxic if swallowed.
Precautionary Statement P264b-P270-P301+P312-P330-P501c
EINECSNumber 201-494-2
RTECSNumber XH2275000
TSCA Yes
Recommended Storage Ambient temperatures

RUO – Research Use Only