Compound C9H13N3O4

4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one

CAS: 951-77-9

Molecular Formula	`C9H13N3O4`
Molecular Weight	227.22 g/mol
LogP	-1.8
Topological Polar Surface Area	108.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	227.0906
Heavy Atoms	16
Complexity	355.0

Chemical Identifiers

CAS Number	951-77-9
SMILES	`C1C(C(OC1N2C=CC(=NC2=O)N)CO)O`
InChIKey	`CKTSBUTUHBMZGZ-SHYZEUOFSA-N`

📖 Product Overview

Compound C9H13N3O4 (CAS: 951-77-9) is a chemical compound with molecular formula C9H13N3O4 and molecular weight 227.22 g/mol. Its IUPAC systematic name is 4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one. LogP -1.8 Topological Polar Surface Area 108.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 4 Rotatable Bonds 2 Exact Mass 227.0906 Heavy Atoms 16 Complexity 355.0 InChI Key: CKTSBUTUHBMZGZ-SHYZEUOFSA-N. SMILES: C1C(C(OC1N2C=CC(=NC2=O)N)CO)O.

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