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Home > Bromides > 1807542-99-9
1807542-99-9 | Benzene, 1-[(4-bromophenyl)sulfonyl]-3-fluoro-
CAS No: 1807542-99-9 Catalog No: AG0022BS MDL No:
Product Description
Catalog Number:
AG0022BS
Chemical Name:
Benzene, 1-[(4-bromophenyl)sulfonyl]-3-fluoro-
CAS Number:
1807542-99-9
Molecular Formula:
C12H8BrFO2S
Molecular Weight:
315.1581
IUPAC Name:
1-(4-bromophenyl)sulfonyl-3-fluorobenzene
InChI:
InChI=1S/C12H8BrFO2S/c13-9-4-6-11(7-5-9)17(15,16)12-3-1-2-10(14)8-12/h1-8H
InChI Key:
MAZKBEBXAXOVPK-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)S(=O)(=O)c1cccc(c1)F
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.941g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.156g/mol
Monoisotopic Mass:
313.941g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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