2-[ (2,4-Difluorophenoxy) methyl]oxirane

CAT: 0127-PC300681-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-PC300681-01Size:1 g

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CAS Number

169286-61-7

MDL Number

MFCD09741082

Purity

=95%

Smiles

Fc1ccc(OCC2CO2)c(F)c1

Chemical Information

2-[(2,4-Difluorophenoxy)methyl]oxirane

CAS Number	169286-61-7
PubChem CID	10397525
IUPAC Name	2-[(2,4-difluorophenoxy)methyl]oxirane
Molecular Formula	C9H8F2O2
Molecular Weight	186.15
XLogP	1.8
Topological Polar Surface Area	21.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	177

SMILES

C1C(O1)COC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C9H8F2O2/c10-6-1-2-9(8(11)3-6)13-5-7-4-12-7/h1-3,7H,4-5H2

InChIKey

MGDNUWJCVFIMAJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 169286-61-7

CID: 10397525

Formula: C9H8F2O2

MW: 186.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	186.15
XLogP3	1.8
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	21.8 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	177
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
PC1023465-01	Methyl 2- (2,4-difluorophenoxy) -2-methylpropanoate
PC1026513	Methyl 4- ((2,3-difluorophenoxy) methyl) benzoate
PC1011387-01	Methyl 4- ((2,6-difluorophenoxy) methyl) benzoate
PC109413-01	Methyl 3-[ (2,4-Difluorophenoxy) methyl]benzoate
PC109466-01	Methyl 6- (2,4-Difluorophenoxy) nicotinate
PC1011245	4- ((2,6-difluorophenoxy) methyl) benzaldehyde
PC1008802-01	3-[ (2,4-Difluorophenoxy) methyl]benzonitrile
OR1039208-01	2-[ (4-Methoxyphenyl) methyl]oxirane
OR26560-01	2-[ (4-Nitrophenoxy) methyl]oxirane
PC31966-01	2-[ (4-Fluorophenoxy) methyl]oxirane

Catalog	Name
sc-328228	Methyl 2-[ (2,4-difluorophenoxy) methyl]benzoate
sc-315151	4-[ (2,4-Difluorophenoxy) methyl]piperidinehydrochloride
265757-01	2-[ (4-Bromophenoxy) methyl]oxirane
sc-340707	2-[ (4-ethylphenoxy) methyl]oxirane
sc-274094	2-[ (4-fluorophenoxy) methyl]oxirane
sc-340737A	2-[ (4-phenoxyphenoxy) methyl]oxirane
LCA39662-01	2-[ (4-Fluorophenyl) methyl]oxirane
RG-A263030-01	2- ((4-Fluorophenoxy) Methyl) Oxirane
sc-274091	2-[ (4-ethoxyphenoxy) methyl]oxirane
sc-274100	2-[ (4-methylphenoxy) methyl]oxirane