3-amino-1H-indazole-6-carbonitrile

3-amino-1H-indazole-6-carbonitrile

CAS: 267413-32-1

Formula: C8H6N4

SMILES: NC1=NNC2=CC(=CC=C12)C#N

IUPAC: 3-amino-1H-indazole-6-carbonitrile

InChI: InChI=1S/C8H6N4/c9-4-5-1-2-6-7(3-5)11-12-8(6)10/h1-3H,(H3,10,11,12)

Composition: C (60.75%), H (3.82%), N (35.42%)

Molar Mass: 158.164

Atom Count: 18

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	158.059246209
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	ZTOXODDIVDMDIE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.81
Topological Polar Surface Area	78.49
Polarizability	17.61
Ring Count	2
Rotatable Bond Count	0

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