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1352222-12-8 | 2-Chloro-2,2-difluoro-1-(3-fluorophenyl)ethanone
CAS No: 1352222-12-8 Catalog No: AG01F9IJ MDL No:
Product Description
Catalog Number:
AG01F9IJ
Chemical Name:
2-Chloro-2,2-difluoro-1-(3-fluorophenyl)ethanone
CAS Number:
1352222-12-8
Molecular Formula:
C8H4ClF3O
Molecular Weight:
208.5650
IUPAC Name:
2-chloro-2,2-difluoro-1-(3-fluorophenyl)ethanone
InChI:
InChI=1S/C8H4ClF3O/c9-8(11,12)7(13)5-2-1-3-6(10)4-5/h1-4H
InChI Key:
WPFXDSSNNHJAGA-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C(=O)C(Cl)(F)F
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.99g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.564g/mol
Monoisotopic Mass:
207.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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