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Theobromine

Theobromine

CAS Number: 83-67-0

Molecular Formula: C7H8N4O2

Purity: --

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About the product

3,7-Dimethylxanthine (CAS 83-67-0) serves as a critical component in the API intermediates market, where its role as a myocardial stimulant and bronchodilator drives steady demand for high-purity fine chemicals required for complex respiratory and cardiovascular formulations. Xantheose (CAS 83-67-0) has become a focal ...

Synonyms

  • Theobromine

Theobromine Specifications

CAS Number
83-67-0
Molecular Formula
C7H8N4O2
Molecular Weight
180.16 g/mol
IUPAC Name
3,7-dimethylpurine-2,6-dione
Canonical SMILES
CN1C=NC2=C1C(=O)NC(=O)N2C
InChI Key
YAPQBXQYLJRXSA-UHFFFAOYSA-N
InChI
InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2/h3H,1-2H3,(H,9,12,13)
PubChem CID
5429
EINECS Number
201-494-2
MDL Number
MFCD00022830
HSN No
29399900

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