CAS
54292-17-0 Purity
96%
54292-17-0 Purity
96%
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8-Hexyl-1,3-dimethyl-7H-purine-2,6-dione
CAS
5429-37-8
Catalog Number
ACM5429378
Category
Other Products
Molecular Weight
264.323 g/mol
Molecular Formula
C13H20N4O2
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Specification
Synonyms
8-Hexyltheophylline, Theophylline, 8-hexyl-, Xanthine, 1,3-dimethyl-8-hexyl-, NSC14129, NSC 14129, CID79481, BRN 1134371, LS-149574, 1H-Purine-2,6-dione, 8-hexyl-3,7-dihydro-1,3-dimethyl-, 1H-Purine-2,6-dione, 8-hexyl-3,7-dihydro-1,3-dimethyl- (9CI), 5429-37-8
IUPAC Name
8-hexyl-1,3-dimethyl-7H-purine-2,6-dione
Canonical SMILES
CCCCCCC1=NC2=C(N1)C(=O)N(C(=O)N2C)C
InChI Key
SHZWWHZISZGGHB-UHFFFAOYSA-N
Boiling Point
482.2ºC at 760 mmHg
Flash Point
245.4ºC
Density
1.191g/cm³
Exact Mass
264.15900
H-Bond Acceptor
3
H-Bond Donor
1
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CAS
54292-18-1 Purity
96%
54292-18-1 Purity
96%
