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2-phenyl-1H-imidazole-4,5-dicarbonitrile

2-phenyl-1H-imidazole-4,5-dicarbonitrile

CAS: 50847-06-8

Formula: C11H6N4

SMILES: N#CC1=C(N=C(N1)C1=CC=CC=C1)C#N

IUPAC: 2-phenyl-1H-imidazole-4,5-dicarbonitrile

InChI: InChI=1S/C11H6N4/c12-6-9-10(7-13)15-11(14-9)8-4-2-1-3-5-8/h1-5H,(H,14,15)

Composition: C (68.03%), H (3.11%), N (28.85%)

Molar Mass: 194.197

Atom Count: 21

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 194.059246209
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey PGSHQANDAMACEF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.06
Topological Polar Surface Area 76.26
Polarizability 21.09
Ring Count 2
Rotatable Bond Count 1

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95% <2 Days 50847-06-8 $51.35-$539.70$51.35$63.37$86.31$113.62$180.26$539.70
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