1- (2,6-difluorophenyl) -2-methoxyethanone

CAT: 0127-PC1009063-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-PC1009063-01Size:250 mg

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CAS Number

1157136-60-1

Purity

97%

Smiles

C1 (cccc (c1C (=O) COC) F) F

Chemical Information

1-(2,6-Difluorophenyl)-2-methoxyethanone

CAS Number	1157136-60-1
PubChem CID	43799532
IUPAC Name	1-(2,6-difluorophenyl)-2-methoxyethanone
Molecular Formula	C9H8F2O2
Molecular Weight	186.15
XLogP	1.7
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	174

SMILES

COCC(=O)C1=C(C=CC=C1F)F

InChI

InChI=1S/C9H8F2O2/c1-13-5-8(12)9-6(10)3-2-4-7(9)11/h2-4H,5H2,1H3

InChIKey

GGPXMYRQHWDMNN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1157136-60-1

CID: 43799532

Formula: C9H8F2O2

MW: 186.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	186.15
XLogP3	1.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	186.04923582
Monoisotopic Mass	186.04923582
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	174
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
PC1012556-01	1- (3-Bromo-2,6-difluorophenyl) -2-methoxyethanone
PC1015113-01	1- (2-chloro-3,6-difluorophenyl) -2-methoxyethanone
PC1009069-01	1- (2,5-difluorophenyl) -2-methoxyethanone
PC1010433-01	1- (2,3-Difluorophenyl) -2-methoxyethanone
PC1009064-01	1- (3,4-Difluorophenyl) -2-methoxyethanone
PC1014446-01	1- (4-Bromo-2,3-difluorophenyl) -2-methoxyethanone
PC1012068-01	1- (2,6-difluoro-3-methylphenyl) -2-methoxyethanone
OR1081680-01	1- (2-Ethylphenyl) -2-methoxyethanone
PC1021094-01	1- (2,6-difluoro-3-iodophenyl) -2-methoxyethanone
OR1080671-01	1- (2-Benzofuranyl) -2-methoxyethanone

Catalog	Name
GQB60867-01	2- (2,6-Difluorophenyl) acetamide
AL BW 0286-01	2- (2,6-difluorophenyl) ethanamine
ZFA68018-01	2- (2,6-Difluorophenyl) propanenitrile
sc-334808A	2- (2,6-difluorophenyl) oxirane
NLB72004-01	2- (2,6-Difluorophenyl) -2-methylpropanamide
sc-231197	2,6-Difluorophenyl isocyanate
GKA65160-01	(2,6-Difluorophenyl) methanesulfonamide
FD67572-01	(2,6-Difluorophenyl) acetone
DKB20482-01	(2,6-Difluorophenyl) methanethiol
270760-01	(2,6-Difluorophenyl) acetonitrile