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102429-07-2 | Ethanone, 2-bromo-1-(2,4-difluorophenyl)-
CAS No: 102429-07-2 Catalog No: AG0007FX MDL No:MFCD00142822
Product Description
Catalog Number:
AG0007FX
Chemical Name:
Ethanone, 2-bromo-1-(2,4-difluorophenyl)-
CAS Number:
102429-07-2
Molecular Formula:
C8H5BrF2O
Molecular Weight:
235.0255
MDL Number:
MFCD00142822
IUPAC Name:
2-bromo-1-(2,4-difluorophenyl)ethanone
InChI:
InChI=1S/C8H5BrF2O/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3H,4H2
InChI Key:
CSGDTHXBRAAOHV-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1ccc(cc1F)F
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.949g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.028g/mol
Monoisotopic Mass:
233.949g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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