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51679-57-3 | 4-[(Difluoromethyl)sulphonyl]bromobenzene
CAS No: 51679-57-3 Catalog No: AG01FHES MDL No:
Product Description
Catalog Number:
AG01FHES
Chemical Name:
4-[(Difluoromethyl)sulphonyl]bromobenzene
CAS Number:
51679-57-3
IUPAC Name:
1-bromo-4-(difluoromethylsulfonyl)benzene
InChI:
InChI=1S/C7H5BrF2O2S/c8-5-1-3-6(4-2-5)13(11,12)7(9)10/h1-4,7H
InChI Key:
LILXEWHLJBFHDS-UHFFFAOYSA-N
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.916g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.076g/mol
Monoisotopic Mass:
269.916g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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