1H-imidazole-2-carbonitrile

1H-imidazole-2-carbonitrile

CAS: 31722-49-3

Formula: C4H3N3

SMILES: N#CC1=NC=CN1

IUPAC: 1H-imidazole-2-carbonitrile

InChI: InChI=1S/C4H3N3/c5-3-4-6-1-2-7-4/h1-2H,(H,6,7)

Composition: C (51.61%), H (3.25%), N (45.14%)

Molar Mass: 93.089

Atom Count: 10

Heavy Atom Count: 7

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	93.032697109
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	QMQZIXCNLUPEIN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	24.21
Topological Polar Surface Area	52.47
Polarizability	9
Ring Count	1
Rotatable Bond Count	0

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