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125733-43-9 | Ethanone, 1-(3,4-dichlorophenyl)-2,2,2-trifluoro-
CAS No: 125733-43-9 Catalog No: AG000OL4 MDL No:MFCD01319995
Product Description
Catalog Number:
AG000OL4
Chemical Name:
Ethanone, 1-(3,4-dichlorophenyl)-2,2,2-trifluoro-
CAS Number:
125733-43-9
Molecular Formula:
C8H3Cl2F3O
Molecular Weight:
243.0100
MDL Number:
MFCD01319995
IUPAC Name:
1-(3,4-dichlorophenyl)-2,2,2-trifluoroethanone
InChI:
InChI=1S/C8H3Cl2F3O/c9-5-2-1-4(3-6(5)10)7(14)8(11,12)13/h1-3H
InChI Key:
YWBUNUGOMAFWHQ-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)c1ccc(c(c1)Cl)Cl
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.951g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.006g/mol
Monoisotopic Mass:
241.951g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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