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8-Chloro Caffeine | CAS Number: 4921-49-7

Catalog Number
ACM4921497
Product Name
8-Chloro Caffeine
Structure
CAS Number
4921-49-7
EC Number
225-552-1
IUPAC Name
8-chloro-1,3,7-trimethylpurine-2,6-dione
Synonyms
8-Chloro-3,7-dihydro-1,3,7-trimethyl-
Molecular Weight
228.64
Exact Mass
228.04100
Molecular Formula
C8H9ClN4O2
Boiling Point
425.4ºC at 760mmHg
Melting Point
190-192ºC
Flash Point
211.1ºC
Density
1.6g/cm3
Purity
96%
Appearance
White Solid
SMILES
CN1C2=C(N=C1Cl)N(C(=O)N(C2=O)C)C
InChIKey
HGKPGBJNNATDRR-UHFFFAOYSA-N
H-Bond Donor
0
H-Bond Acceptor
3
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Email:
Tel:1-201-478-8534
1-516-662-5404
Fax: 1-516-927-0118
Address: Suite 212, Waverly Plaza, 755 Waverly Avenue, Holtsville, NY 11742, USA