N-methyl-N-(7H-purin-6-yl)nitrous amide

CAS: 21928-82-5

Molecular Formula	`C6H6N6O`
Molecular Weight	178.15 g/mol
LogP	0.3
Topological Polar Surface Area	87.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	1
Exact Mass	178.0603
Heavy Atoms	13
Complexity	200.0

Chemical Identifiers

CAS Number	21928-82-5
SMILES	`CN(C1=NC=NC2=C1NC=N2)N=O`
InChIKey	`HTWGDSKVENTDTB-UHFFFAOYSA-N`

📖 Product Overview

N-methyl-N-(7H-purin-6-yl)nitrous amide (CAS: 21928-82-5) is a chemical compound with molecular formula C6H6N6O and molecular weight 178.15 g/mol. Its IUPAC systematic name is N-methyl-N-(7H-purin-6-yl)nitrous amide. LogP 0.3 Topological Polar Surface Area 87.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 1 Exact Mass 178.0603 Heavy Atoms 13 Complexity 200.0 InChI Key: HTWGDSKVENTDTB-UHFFFAOYSA-N. SMILES: CN(C1=NC=NC2=C1NC=N2)N=O.

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