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7716-86-1 | Ethanone, 1-(4-bromophenyl)-2,2-dichloro-
CAS No: 7716-86-1 Catalog No: AG0055HG MDL No:
Product Description
Catalog Number:
AG0055HG
Chemical Name:
Ethanone, 1-(4-bromophenyl)-2,2-dichloro-
CAS Number:
7716-86-1
Molecular Formula:
C8H5BrCl2O
Molecular Weight:
267.9347
IUPAC Name:
1-(4-bromophenyl)-2,2-dichloroethanone
InChI:
InChI=1S/C8H5BrCl2O/c9-6-3-1-5(2-4-6)7(12)8(10)11/h1-4,8H
InChI Key:
LZLOFHDNIIKBIU-UHFFFAOYSA-N
SMILES:
ClC(C(=O)c1ccc(cc1)Br)Cl
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.89g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.931g/mol
Monoisotopic Mass:
265.89g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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