4- (3-Methylphenyl) phenol

CAT: 0127-OR954768-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR954768-01Size:1 g

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CAS Number

191724-08-0

MDL Number

MFCD01910124

Purity

96%

Smiles

Cc1cccc(c1)c2ccc(O)cc2

Chemical Information

4-(3-Methylphenyl)phenol

CAS Number	191724-08-0
PubChem CID	1382790
IUPAC Name	4-(3-methylphenyl)phenol
Molecular Formula	C13H12O
Molecular Weight	184.23
XLogP	3.6
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	14
Formal Charge	0
Complexity	170

SMILES

CC1=CC(=CC=C1)C2=CC=C(C=C2)O

InChI

InChI=1S/C13H12O/c1-10-3-2-4-12(9-10)11-5-7-13(14)8-6-11/h2-9,14H,1H3

InChIKey

DMTSNKPXUWEOBB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 191724-08-0

CID: 1382790

Formula: C13H12O

MW: 184.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	184.23
XLogP3	3.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	184.088815002
Monoisotopic Mass	184.088815002
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	170
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
OR954770-01	3- (4-Methylphenyl) phenol
PC1022527	4- (3-Fluoro-4-methylphenyl) phenol
OR954769	2- (4-Methylphenyl) phenol
OR954765-01	4- (2-Methylphenyl) phenol
OR954766	2- (3-Methylphenyl) phenol
OR954764-01	3- (2-Methylphenyl) phenol
OR1094727	2-Formyl-4- (4-methylphenyl) phenol
OR310712	2-{[ (4-Methylphenyl) amino]methyl}phenol
OR21088	4-bromo-2-{[ (3-chloro-4-methylphenyl) imino]methyl}phenol
OR1082385-01	(4-chloro-3-methylphenyl) (3-methylphenyl) -Methanone

Catalog	Name
TRC-M260085-250MG	3-[(4-Methylphenyl)amino]phenol
423434-01	3-[ (4-Methylphenyl) amino]phenol
422654-01	3- (3-Fluoro-4-methylphenyl) phenol
424375-01	3-Bromo-5- (4-methylphenyl) phenol
428857-01	4- (3-Fluoro-4-methylphenyl) phenol
422467-01	3- (2-Fluoro-5-methylphenyl) phenol
429144-01	4- (4-Fluoro-3-methylphenyl) phenol
sc-492966	2-{[ (3-methylphenyl) amino]methyl}phenol
sc-492212	2-{[ (4-bromo-3-methylphenyl) amino]methyl}phenol
sc-493419	2-{[ (3-Fluoro-2-methylphenyl) amino]methyl}phenol