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1352205-76-5 | 2-Chloro-1-(3-fluoro-5-methylphenyl)ethanone
CAS No: 1352205-76-5 Catalog No: AG01FAMW MDL No:
Product Description
Catalog Number:
AG01FAMW
Chemical Name:
2-Chloro-1-(3-fluoro-5-methylphenyl)ethanone
CAS Number:
1352205-76-5
Molecular Formula:
C9H8ClFO
Molecular Weight:
186.6106
IUPAC Name:
2-chloro-1-(3-fluoro-5-methylphenyl)ethanone
InChI:
InChI=1S/C9H8ClFO/c1-6-2-7(9(12)5-10)4-8(11)3-6/h2-4H,5H2,1H3
InChI Key:
SYKPONWGWARGKJ-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1cc(C)cc(c1)F
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.025g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.61g/mol
Monoisotopic Mass:
186.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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