2-[ (3-Fluorophenyl) methyl]oxirane

CAT: 0926-MCA82644-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-MCA82644-01Size:50 mg

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CAS Number

62826-44-2

MDL Number

MFCD22414054

Smiles

C1C (O1) CC2=CC (=CC=C2) F

Molecular Formula

C9H9FO

Molecular Weight

152.16 g/mol

Controlled

Chemical Information

2-[(3-Fluorophenyl)methyl]oxirane

CAS Number	62826-44-2
PubChem CID	12407138
IUPAC Name	2-[(3-fluorophenyl)methyl]oxirane
Molecular Formula	C9H9FO
Molecular Weight	152.16
XLogP	2
Topological Polar Surface Area	12.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	138

SMILES

C1C(O1)CC2=CC(=CC=C2)F

InChI

InChI=1S/C9H9FO/c10-8-3-1-2-7(4-8)5-9-6-11-9/h1-4,9H,5-6H2

InChIKey

DOTDGMYFHRKGJS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 62826-44-2

CID: 12407138

Formula: C9H9FO

MW: 152.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	152.16
XLogP3	2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	152.063743068
Monoisotopic Mass	152.063743068
Topological Polar Surface Area	12.5 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	138
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
LCA39662-01	2-[ (4-Fluorophenyl) methyl]oxirane
AKB16332-01	2-{[ (2-Fluorophenyl) methoxy]methyl}oxirane
ZCA24917-01	2- (2-Fluorophenyl) oxirane
ZDA58000-01	2-{[Bis (4-fluorophenyl) methoxy]methyl}oxirane
FF45278-01	(R) - (3-Fluorophenyl) oxirane
LJC22567-01	2- (3-Bromo-4-fluorophenyl) oxirane
QDC08822-01	2- (4-Chloro-3-fluorophenyl) oxirane
ABA64208-01	2-[ (3-Chlorophenyl) methyl]oxirane
FO175093	2-[[3- (Oxiran-2-ylmethoxy) phenoxy]methyl]oxirane
QDC10635-01	2- (2-Chloro-4-fluorophenyl) oxirane

Catalog	Name
PC1021795-01	2-[ (2-Fluorophenyl) methyl]oxirane
276852-01	(R) - (3-Fluorophenyl) oxirane
TRC-F791730-750MG	(R)-(3-Fluorophenyl)oxirane
sc-339667	2- (3-fluorophenyl) oxirane
TRC-F589608-1G	2-(3-Fluorophenyl)oxirane
sc-341037A	2-{[bis (4-fluorophenyl) methoxy]methyl}oxirane
PC1015395-01	2-[ (4-Bromo-2-fluorophenyl) methyl]oxirane
sc-334719A	2- (2-fluorophenyl) oxirane
sc-229232	(S) - (4-Fluorophenyl) oxirane
sc-225075	2- (4-Fluorophenyl) oxirane