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8-(3-Chlorostyryl)caffeine

Also known as: Caffeine Impurities or impurities of Caffeine
Chemical Name 8-(3-Chlorostyryl)caffeine
CAT No. CS-T-73053
CAS Registry# 147700-11-6
Status Under Certification (Usually dispatched in 5 days)
Category Impurities
Hazardous This is not a Hazardous Compound
COA View Sample COA
Controlled No

Additional Information


Controlled No
Parent API Caffeine
Smileys CN1C(/C=C/C2=CC(Cl)=CC=C2)=NC3=C1C(N(C)C(N3C)=O)=O
Canonical Smiles CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)C=CC3=CC(=CC=C3)Cl
InchIKey WBWFIUAVMCNYPG-BQYQJAHWSA-N
Inchl InChI=1S/C16H15ClN4O2/c1-19-12(8-7-10-5-4-6-11(17)9-10)18-14-13(19)15(22)21(3)16(23)20(14)2/h4-9H,1-3H3/b8-7+
IUPAC 8-[(E)-2-(3-chlorophenyl)ethenyl]-1,3,7-trimethylpurine-2,6-dione
Hazardous No


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