1-phenylcyclobutane-1-carbonitrile

1-phenylcyclobutane-1-carbonitrile

CAS: 14377-68-5

Formula: C11H11N

SMILES: N#CC1(CCC1)C1=CC=CC=C1

IUPAC: 1-phenylcyclobutane-1-carbonitrile

InChI: InChI=1S/C11H11N/c12-9-11(7-4-8-11)10-5-2-1-3-6-10/h1-3,5-6H,4,7-8H2

Composition: C (84.04%), H (7.05%), N (8.91%)

Molar Mass: 157.216

Atom Count: 23

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	157.089149358
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	DHIDUDPFTZJPCQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.22
Topological Polar Surface Area	23.79
Polarizability	18.67
Ring Count	2
Rotatable Bond Count	1

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