4-Cyano-4'-hydroxybiphenyl

CAT: 0926-FC00726-01Size: 10 gDry Ice: NoHazardous: No

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CAT#:0926-FC00726-01Size:10 g

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CAS Number

19812-93-2

Synonyms

4'-Hydroxybiphenyl-4-carbonitrile

MDL Number

MFCD00059625

Smiles

C1=CC (=CC=C1C#N) C2=CC=C (C=C2) O

Molecular Formula

C13H9NO

Molecular Weight

195.22 g/mol

Controlled

Chemical Information

4'-Hydroxy-4-biphenylcarbonitrile

CAS Number	19812-93-2
PubChem CID	140610
IUPAC Name	4-(4-hydroxyphenyl)benzonitrile
Molecular Formula	C13H9NO
Molecular Weight	195.22
XLogP	2.9
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	239

SMILES

C1=CC(=CC=C1C#N)C2=CC=C(C=C2)O

InChI

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

InChIKey

ZRMIETZFPZGBEB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 19812-93-2

CID: 140610

Formula: C13H9NO

MW: 195.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	195.22
XLogP3	2.9
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	239
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
FN102618-01	Nonafluoro-4-hydroxybiphenyl
PYB35686-01	4'-Fluoro-4-hydroxybiphenyl-3-carbonitrile
FC32340-01	4-Cyano-4'-octylbiphenyl
FC02179-01	4-Cyano-4'-aminobiphenyl
FC61783	4-Cyano-4'-methylbiphenyl
LXB42091-01	(2-Cyano-4-hydroxyphenyl) boronic acid
CBA57905-01	4-Cyano-4,4-dimethylbutanoic acid
BCA30458-01	4-Cyano-4-phenylpiperidine hydrochloride
LAC64942-01	Methyl 2- (4-cyano-2-hydroxyphenyl) acetate
FC41214-01	4-Cyano-2-hydroxybenzaldehyde

Catalog	Name
GK8868-25g	4-Hydroxybiphenyl
TRC-C585835-10MG	4-Chloro-4'-hydroxybiphenyl
PC408434-01	4-Fluoro-4'-hydroxybiphenyl
GTR19254355-01	4-Bromo-4'-hydroxybiphenyl
OR1096678	4-Ethoxy-4'-hydroxybiphenyl
425220-01	3-Cyano-3'-hydroxybiphenyl
35939801-1kg	4-Hydroxybiphenyl (4-Phenylphenol)
PC5378-01	2',4'-Difluoro-4-hydroxybiphenyl
OR60002-01	3-Amino-4-hydroxybiphenyl
TRC-H817610-250MG	4'-Hydroxybiphenyl-3-carboxylic Acid