CAS
8048-19-9 Purity
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8048-19-9 Purity
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1,3-Dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol
CAS
8048-39-3
Catalog Number
ACM8048393
Category
Other Products
Molecular Weight
375.378 g/mol
Molecular Formula
C14H25N5O7
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Specification
Synonyms
Theophylline meglumine, AC1L2NM5, UNII-1442U7XKHA, 1,3-dimethyl-7H-purine-2,6-dione; 6-(methylamino)hexane-1,2,3,4,5-pentol, 8048-39-3
IUPAC Name
1,3-dimethyl-7H-purine-2,6-dione;6-(methylamino)hexane-1,2,3,4,5-pentol
Canonical SMILES
CNCC(C(C(C(CO)O)O)O)O.CN1C2=C(C(=O)N(C1=O)C)NC=N2
InChI Key
SYVYGLNOQIZPJI-UHFFFAOYSA-N
Exact Mass
375.17500
H-Bond Acceptor
9
H-Bond Donor
7
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