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116340-67-1 | Benzenesulfonamide, 4-bromo-2-methyl-
CAS No: 116340-67-1 Catalog No: AG000C8Y MDL No:MFCD08234785
Product Description
Catalog Number:
AG000C8Y
Chemical Name:
Benzenesulfonamide, 4-bromo-2-methyl-
CAS Number:
116340-67-1
Molecular Formula:
C7H8BrNO2S
Molecular Weight:
250.1129
MDL Number:
MFCD08234785
IUPAC Name:
4-bromo-2-methylbenzenesulfonamide
InChI:
InChI=1S/C7H8BrNO2S/c1-5-4-6(8)2-3-7(5)12(9,10)11/h2-4H,1H3,(H2,9,10,11)
InChI Key:
BTSVWIADDUQGGP-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)C)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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