3-(3-nitrophenyl)-1H-pyrazole

3-(3-nitrophenyl)-1H-pyrazole

CAS: 59843-77-5

Formula: C9H7N3O2

SMILES: [O-][N+](=O)C1=CC=CC(=C1)C1=NNC=C1

IUPAC: 3-(3-nitrophenyl)-1H-pyrazole

InChI: InChI=1S/C9H7N3O2/c13-12(14)8-3-1-2-7(6-8)9-4-5-10-11-9/h1-6H,(H,10,11)

Composition: C (57.14%), H (3.73%), N (22.21%), O (16.91%)

Molar Mass: 189.174

Atom Count: 21

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	189.053826477
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	RUWXJVIBNZSEQD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.83
Topological Polar Surface Area	71.82
Polarizability	19.94
Ring Count	2
Rotatable Bond Count	2

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