2-Hydroxy-1- (4-methylphenyl) propan-1-one

CAT: 0926-QAA48226-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-QAA48226-01Size:50 mg

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CAS Number

15482-26-5

MDL Number

MFCD01695145

Smiles

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

Molecular Formula

C10H12O2

Molecular Weight

164.2 g/mol

Controlled

Chemical Information

2-Hydroxy-1-(4-methylphenyl)-1-propanone

CAS Number	15482-26-5
PubChem CID	203918
IUPAC Name	2-hydroxy-1-(4-methylphenyl)propan-1-one
Molecular Formula	C10H12O2
Molecular Weight	164.20
XLogP	1.7
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	157

SMILES

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

InChI

InChI=1S/C10H12O2/c1-7-3-5-9(6-4-7)10(12)8(2)11/h3-6,8,11H,1-2H3

InChIKey

ZUGZGQZJVSELKS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 15482-26-5

CID: 203918

Formula: C10H12O2

MW: 164.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	164.20
XLogP3	1.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	164.083729621
Monoisotopic Mass	164.083729621
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	157
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
CAA88755-01	1- (4-Hydroxy-2-methylphenyl) propan-1-one
CAA88652-01	1- (2-Hydroxy-4-methylphenyl) propan-1-one
JDB02522-01	1- (4-bromo-2-methylphenyl) propan-1-one
SFA43805-01	1-Bromo-1- (4-methylphenyl) propan-2-one
QAA48228-01	2-Hydroxy-1- (4-methoxyphenyl) propan-1-one
ZAA25314-01	1-Chloro-3- (4-methylphenyl) propan-2-one
VCA76970-01	1,3-Bis (4-methylphenyl) propan-2-one
EAA39575-01	2- (4-Methylphenyl) propan-1-amine
YGA85166-01	1- (2-Hydroxy-4-methylphenyl) pentan-1-one
HAA53714-01	1- (3,4-Dimethoxy-2-methylphenyl) propan-2-one

Catalog	Name
OR1047575-01	1- (4-Hydroxy-3-methylphenyl) propan-1-one
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OR1091536-01	1- (4- (cyclopropylmethoxy) -2-methylphenyl) propan-1-one
OR1044632-01	1- (4-Bromo-2-methylphenyl) propan-1-one
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228387-01	1- (2-Hydroxy-5-methylphenyl) propan-1-one 98+% (GC)
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PC1021049-01	1- (2,4-difluoro-3-methylphenyl) propan-1-one