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201206-41-9 | 2-bromo-1-(4-bromophenyl)-2-fluoroethan-1-one
CAS No: 201206-41-9 Catalog No: AG01ELXH MDL No:
Product Description
Catalog Number:
AG01ELXH
Chemical Name:
2-bromo-1-(4-bromophenyl)-2-fluoroethan-1-one
CAS Number:
201206-41-9
Molecular Formula:
C8H5Br2FO
Molecular Weight:
295.9311
IUPAC Name:
2-bromo-1-(4-bromophenyl)-2-fluoroethanone
InChI:
InChI=1S/C8H5Br2FO/c9-6-3-1-5(2-4-6)7(12)8(10)11/h1-4,8H
InChI Key:
JMYQHYGCPSEEPJ-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)C(=O)C(Br)F
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.867g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.933g/mol
Monoisotopic Mass:
293.869g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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