2-(3-hydroxyphenyl)acetonitrile

2-(3-hydroxyphenyl)acetonitrile

CAS: 25263-44-9

Formula: C8H7NO

SMILES: OC1=CC(CC#N)=CC=C1

IUPAC: 2-(3-hydroxyphenyl)acetonitrile

InChI: InChI=1S/C8H7NO/c9-5-4-7-2-1-3-8(10)6-7/h1-3,6,10H,4H2

Composition: C (72.17%), H (5.30%), N (10.52%), O (12.02%)

Molar Mass: 133.15

Atom Count: 17

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	133.052763849
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	IEOUEWOHAFNQCO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.33
Topological Polar Surface Area	44.02
Polarizability	14.45
Ring Count	1
Rotatable Bond Count	1

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