Compound C9H6N6NaO+

sodium 3-(2H-tetrazol-5-yl)quinazolin-4-one

CAS: 87693-14-9

Molecular Formula	`C9H6N6NaO+`
Molecular Weight	237.17 g/mol
Topological Polar Surface Area	87.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	1
Exact Mass	237.05008
Heavy Atoms	17
Complexity	319.0

Chemical Identifiers

CAS Number	87693-14-9
SMILES	`C1=CC=C2C(=C1)C(=O)N(C=N2)C3=NNN=N3.[Na+]`
InChIKey	`PQKMDJBZJHXUHW-UHFFFAOYSA-N`

📖 Product Overview

Compound C9H6N6NaO+ (CAS: 87693-14-9) is a chemical compound with molecular formula C9H6N6NaO+ and molecular weight 237.17 g/mol. Its IUPAC systematic name is sodium 3-(2H-tetrazol-5-yl)quinazolin-4-one. Topological Polar Surface Area 87.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 1 Exact Mass 237.05008 Heavy Atoms 17 Complexity 319.0 InChI Key: PQKMDJBZJHXUHW-UHFFFAOYSA-N. SMILES: C1=CC=C2C(=C1)C(=O)N(C=N2)C3=NNN=N3.[Na+].

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