2- (4-Cyanophenyl) phenol

CAT: 0127-OR954779Size: 1 gDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR954779Size:1 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

127703-35-9

MDL Number

MFCD06802201

Purity

96%

Smiles

Oc1ccccc1c2ccc(cc2)C#N

Chemical Information

2'-Hydroxy[1,1'-biphenyl]-4-carbonitrile

CAS Number	127703-35-9
PubChem CID	14448116
IUPAC Name	4-(2-hydroxyphenyl)benzonitrile
Molecular Formula	C13H9NO
Molecular Weight	195.22
XLogP	2.8
Topological Polar Surface Area	44
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	15
Formal Charge	0
Complexity	247

SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)C#N)O

InChI

InChI=1S/C13H9NO/c14-9-10-5-7-11(8-6-10)12-3-1-2-4-13(12)15/h1-8,15H

InChIKey

QNZKGZMRMGIXKO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 127703-35-9

CID: 14448116

Formula: C13H9NO

MW: 195.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	195.22
XLogP3	2.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	195.068413911
Monoisotopic Mass	195.068413911
Topological Polar Surface Area	44 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	247
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR954778-01	4- (3-Cyanophenyl) phenol
OR400482	2- (4-Cyanophenyl) oxirane
OR954658-01	6- (4-Cyanophenyl) -2-hydroxypyridine
OR72619	Ethyl 2- (4-Cyanophenyl) hydrazinecarboxylate
OR936417-01	1- (4-Cyanophenyl) -2-nitroethene
OR78142-01	2- (4-Cyanophenyl) propanoic acid
OR1044626-01	Methyl 2- (4-cyanophenyl) -2-methylpropanoate
OR1072175-01	Methyl 2- (4-cyanophenyl) -2-oxoacetate
OR1064965-01	Ethyl 2- (4-cyanophenyl) -2-hydroxyacetate
OR1093837	2- (4-cyanophenyl) -2-oxoacetic acid

Catalog	Name
428834-01	4- (3-Cyanophenyl) phenol
413734-01	2- (4-Cyanophenyl) phenol
429075-01	4- (4-Chloro-3-cyanophenyl) phenol
417271-01	2-Cyano-4- (4-cyanophenyl) phenol
417284-01	2-Cyano-5- (4-cyanophenyl) phenol
425242-01	3-Cyano-5- (4-cyanophenyl) phenol
277945-01	4- (4-Fluorophenoxy) phenol
266213-01	4- (4-Bromophenoxy) phenol
429181-01	4- (4-Fluorophenyl) phenol
sc-261338A	4- (4-Fluorophenylethynyl) phenol