(2,3-difluorophenyl) (2-fluorophenyl) -Methanone

CAT: 0127-PC1011021-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-PC1011021-01Size:250 mg

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CAS Number

1407120-77-7

Purity

95%

Smiles

C (=O) (c1c (F) c (F) ccc1) c1c (F) cccc1

Chemical Information

Methanone, (2,3-difluorophenyl)(2-fluorophenyl)-

CAS Number	1407120-77-7
PubChem CID	63990254
IUPAC Name	(2,3-difluorophenyl)-(2-fluorophenyl)methanone
Molecular Formula	C13H7F3O
Molecular Weight	236.19
XLogP	3.6
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	17
Formal Charge	0
Complexity	282

SMILES

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

InChI

InChI=1S/C13H7F3O/c14-10-6-2-1-4-8(10)13(17)9-5-3-7-11(15)12(9)16/h1-7H

InChIKey

LHLBYZJPAJZJGT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1407120-77-7

CID: 63990254

Formula: C13H7F3O

MW: 236.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	236.19
XLogP3	3.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	236.04489933
Monoisotopic Mass	236.04489933
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	282
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
PC1010330-01	(3,5-difluorophenyl) (2-fluorophenyl) -Methanone
PC1010326-01	(2,6-difluorophenyl) (3-fluorophenyl) -Methanone
PC1008959-01	(2,5-difluorophenyl) (3-fluorophenyl) -Methanone
PC1011839-01	(2,6-difluorophenyl) (2-fluorophenyl) -Methanone
PC1008962-01	(2,5-difluorophenyl) (2-fluorophenyl) -Methanone
PC1025393	(3,5-Difluorophenyl) (3-fluorophenyl) methanone
PC1015335-01	(2,5-difluorophenyl) (4-fluorophenyl) methanone
PC1011022-01	(2,3-difluorophenyl) (3-fluorophenyl) methanol
PC1011875-01	Cyclobutyl (2,3-difluorophenyl) methanone
PC1010577	Cyclohexyl (2,3-difluorophenyl) methanone

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SDC11140-01	(3-Chloro-2-fluorophenyl) (cyclopropyl) methanone
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