1- (4-Fluorophenyl) -2-hydroxyethan-1-one

CAT: 0024-sc-258463Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-258463Size:5 g

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CAS Number

403-31-6

Chemical Information

1-(4-Fluorophenyl)-2-hydroxyethanone

CAS Number	403-31-6
PubChem CID	2810715
IUPAC Name	1-(4-fluorophenyl)-2-hydroxyethanone
Molecular Formula	C8H7FO2
Molecular Weight	154.14
XLogP	1.1
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	139

SMILES

C1=CC(=CC=C1C(=O)CO)F

InChI

InChI=1S/C8H7FO2/c9-7-3-1-6(2-4-7)8(11)5-10/h1-4,10H,5H2

InChIKey

CCNZMIDUTPQMIK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 403-31-6

CID: 2810715

Formula: C8H7FO2

MW: 154.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	154.14
XLogP3	1.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	154.04300762
Monoisotopic Mass	154.04300762
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	139
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
sc-286985	1- (2-Fluorophenyl) piperidin-4-one
sc-286985A	1- (2-Fluorophenyl) piperidin-4-one
sc-258464A	1- (4-Fluorophenyl) -2-methylpropan-1-one
sc-258464	1- (4-Fluorophenyl) -2-methylpropan-1-one
sc-258446	1- (4-Bromo-2-fluorophenyl) ethan-1-one
sc-491058	2- (1- (4-Fluorophenyl) butan-1-one) haloperidol
sc-258446A	1- (4-Bromo-2-fluorophenyl) ethan-1-one
sc-333405	1-[2- (4-fluorophenyl) ethyl]piperidin-4-one
sc-341478A	2-bromo-1- (4-fluorophenyl) propan-1-one
sc-333405A	1-[2- (4-fluorophenyl) ethyl]piperidin-4-one

Catalog	Name
PC101939-01	1- (3-Fluorophenyl) -2-hydroxyethan-1-one
CBA99356	1- (4-Chlorophenyl) -2-hydroxyethan-1-one
FB76397-01	1- (4-Bromophenyl) -2-hydroxyethan-1-one
DEA32324-01	1- (4-Ethylphenyl) -2-hydroxyethan-1-one
WJB87899-01	1- (2,4-Dimethoxyphenyl) -2-hydroxyethan-1-one
OR32597-01	1- (3,4-Dichlorophenyl) -2-hydroxyethan-1-one
OR1037321-01	2- (4-Bromophenyl) -1- (4- (dimethylamino) phenyl) -2-hydroxyethan-1-one
CMB80205-01	1- (3-Chloro-4-methoxyphenyl) -2-hydroxyethan-1-one
CDA38764	1,2-Bis (4-tert-butylphenyl) -2-hydroxyethan-1-one
PC1006213-01	1- (4-Fluorophenyl) piperazin-2-one