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116547-91-2 | Methanesulfonamide, N-(2-bromophenyl)-
CAS No: 116547-91-2 Catalog No: AG000CRM MDL No:MFCD00585027
Product Description
Catalog Number:
AG000CRM
Chemical Name:
Methanesulfonamide, N-(2-bromophenyl)-
CAS Number:
116547-91-2
Molecular Formula:
C7H8BrNO2S
Molecular Weight:
250.1129
MDL Number:
MFCD00585027
IUPAC Name:
N-(2-bromophenyl)methanesulfonamide
InChI:
InChI=1S/C7H8BrNO2S/c1-12(10,11)9-7-5-3-2-4-6(7)8/h2-5,9H,1H3
InChI Key:
HRLPDILAYHUIIF-UHFFFAOYSA-N
SMILES:
Brc1ccccc1NS(=O)(=O)C
Properties
Complexity:
234
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:
2
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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