1- (4-Hydroxyphenyl) -2-phenylethanone

CAT: 0127-OR1027094-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1027094-01Size:250 mg

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CAS Number

2491-32-9

Synonyms

1- (4-hydroxyphenyl) -2-phenylethanone

Purity

98%

Smiles

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

Chemical Information

Benzyl 4-hydroxyphenyl ketone

1-(4-hydroxyphenyl)-2-phenylethan-1-one is a stilbenoid.

CAS Number	2491-32-9
PubChem CID	75607
IUPAC Name	1-(4-hydroxyphenyl)-2-phenylethanone
Molecular Formula	C14H12O2
Molecular Weight	212.24
XLogP	2.8
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	16
Formal Charge	0
Complexity	223

SMILES

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

InChI

InChI=1S/C14H12O2/c15-13-8-6-12(7-9-13)14(16)10-11-4-2-1-3-5-11/h1-9,15H,10H2

InChIKey

JBQTZLNCDIFCCO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2491-32-9

CID: 75607

Formula: C14H12O2

MW: 212.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	212.24
XLogP3	2.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	212.083729621
Monoisotopic Mass	212.083729621
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	223
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
BUP23810-01	1- (5-Bromo-2-hydroxyphenyl) -2-phenylethanone
PC9944-01	1- (4-Fluorophenyl) -2-phenylethanone
OR1008938-01	1- (4-Bromophenyl) -2-Phenylethanone
OR1092210-01	1- (4-Ethoxyphenyl) -2-phenylethanone
OR1038674	2- (4-Chlorophenyl) -1-phenylethanone
OR95998-01	1- (2,4-Dihydroxyphenyl) -2-phenylethanone
PC1009585-01	1- (2-Fluoro-4-methylphenyl) -2-phenylethanone
OR1100591-01	2-Cyclohexyl-1-phenylethanone
OR1102770-01	2-Cyclopropyl-1-phenylethanone
OR1056600-01	2-Mercapto-1-phenylethanone

Catalog	Name
GTR19254211-01	1- (5-Bromo-2-hydroxyphenyl) -2-phenylethanone
TRC-C377865-1G	2-(4-Chlorophenyl)-1-phenylethanone
sc-258465A	1- (4-Fluorophenyl) -2-phenylethanone
sc-273856	2- (4-chlorophenyl) -1-phenylethanone
FH HF 0063-01	2- (4-bromophenyl) -1-phenylethanone
FH HF 0066-01	1- (4-bromophenyl) -2-phenylethanone
sc-302449	1- (4-Phenoxyphenyl) -2-phenylethanone
sc-339744A	2- (3,4-dimethylphenyl) -1-phenylethanone
C4980-22	1-[4- (2-Chloroethoxy) phenyl]-2-phenylethanone
AR-F01512-01	1- (2-hydroxy-4-isopropoxyphenyl) -2-phenylethanone