5-nitrophthalazine

5-nitrophthalazine

CAS: 89898-86-2

Formula: C8H5N3O2

SMILES: [O-][N+](=O)C1=CC=CC2=CN=NC=C12

IUPAC: 5-nitrophthalazine

InChI: InChI=1S/C8H5N3O2/c12-11(13)8-3-1-2-6-4-9-10-5-7(6)8/h1-5H

Composition: C (54.86%), H (2.88%), N (23.99%), O (18.27%)

Molar Mass: 175.147

Atom Count: 18

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	175.038176413
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	NWASGBYNFZVASN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.54
Topological Polar Surface Area	68.92
Polarizability	17.92
Ring Count	2
Rotatable Bond Count	1

Suppliers

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	89898-86-2		$90.79-$414.87$90.79$153.84$414.87