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Home > Product > Heterocyclic Organic Compounds > 8-(2-Hydroxyethylsulfanyl)-1,3,7-trimethylpurine-2,6-dione

8-(2-Hydroxyethylsulfanyl)-1,3,7-trimethylpurine-2,6-dione | CAS Number: 114864-92-5

Catalog Number
ACM114864925
Product Name
8-(2-Hydroxyethylsulfanyl)-1,3,7-trimethylpurine-2,6-dione
Structure
CAS Number
114864-92-5
IUPAC Name
8-(2-hydroxyethylsulfanyl)-1,3,7-trimethylpurine-2,6-dione
Synonyms
8-((2-Hydroxyethyl)thio)caffeine, BRN 0385021, CID41792, CAFFEINE, 8-((2-HYDROXYETHYL)THIO)-, LS-48584, 4-26-00-02735 (Beilstein Handbook Reference), 114864-92-5
Molecular Weight
270.308 g/mol
Exact Mass
270.07900
Molecular Formula
C10H14N4O3S
Boiling Point
508.8ºC at 760mmHg
Flash Point
261.5ºC
Density
1.52g/cm3
Purity
96%
SMILES
CN1C2=C(N=C1SCCO)N(C(=O)N(C2=O)C)C
InChIKey
REVYYWXIURTZMT-UHFFFAOYSA-N
H-Bond Donor
1
H-Bond Acceptor
4
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