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210824-69-4 | Benzenesulfonamide, 3-bromo-4-methyl-
CAS No: 210824-69-4 Catalog No: AG002KZ8 MDL No:MFCD09801033
Product Description
Catalog Number:
AG002KZ8
Chemical Name:
Benzenesulfonamide, 3-bromo-4-methyl-
CAS Number:
210824-69-4
Molecular Formula:
C7H8BrNO2S
Molecular Weight:
250.1129
MDL Number:
MFCD09801033
IUPAC Name:
3-bromo-4-methylbenzenesulfonamide
InChI:
InChI=1S/C7H8BrNO2S/c1-5-2-3-6(4-7(5)8)12(9,10)11/h2-4H,1H3,(H2,9,10,11)
InChI Key:
CFMBNGJNYNLPDL-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1Br)S(=O)(=O)N
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.946g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.11g/mol
Monoisotopic Mass:
248.946g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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