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(2-fluorophenoxy) acetyl chloride

CAT: 0024-sc-335211Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-335211Size:100 mg
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CAS Number
2965-17-5

Chemical Information

(2-Fluorophenoxy)acetyl chloride
CAS Number2965-17-5
PubChem CID3126947
IUPAC Name2-(2-fluorophenoxy)acetyl chloride
Molecular FormulaC8H6ClFO2
Molecular Weight188.58
XLogP2.4
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity163
SMILES
C1=CC=C(C(=C1)OCC(=O)Cl)F
InChI
InChI=1S/C8H6ClFO2/c9-8(11)5-12-7-4-2-1-3-6(7)10/h1-4H,5H2
InChIKey
XSLKRUIYILEVAI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (2-Fluorophenoxy)acetyl chloride
CAS: 2965-17-5
CID: 3126947
Formula: C8H6ClFO2
MW: 188.58
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight188.58
XLogP32.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass188.0040353
Monoisotopic Mass188.0040353
Topological Polar Surface Area26.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity163
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes