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161581-99-3 | Methanone, (4-bromophenyl)(2-fluoro-4-hydroxyphenyl)-
CAS No: 161581-99-3 Catalog No: AG001VPT MDL No:
Product Description
Catalog Number:
AG001VPT
Chemical Name:
Methanone, (4-bromophenyl)(2-fluoro-4-hydroxyphenyl)-
CAS Number:
161581-99-3
Molecular Formula:
C13H8BrFO2
Molecular Weight:
295.1038
IUPAC Name:
(4-bromophenyl)-(2-fluoro-4-hydroxyphenyl)methanone
InChI:
InChI=1S/C13H8BrFO2/c14-9-3-1-8(2-4-9)13(17)11-6-5-10(16)7-12(11)15/h1-7,16H
InChI Key:
BNOUBIJDOMWKPY-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)C(=O)c1ccc(cc1F)O
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.969g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
295.107g/mol
Monoisotopic Mass:
293.969g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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