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850429-67-3 | N-Benzyl-3-bromo-4-methylbenzenesulfonamide
CAS No: 850429-67-3 Catalog No: AG004SMY MDL No:MFCD07363832
Product Description
Catalog Number:
AG004SMY
Chemical Name:
N-Benzyl-3-bromo-4-methylbenzenesulfonamide
CAS Number:
850429-67-3
Molecular Formula:
C14H14BrNO2S
Molecular Weight:
340.2355
MDL Number:
MFCD07363832
IUPAC Name:
N-benzyl-3-bromo-4-methylbenzenesulfonamide
InChI:
InChI=1S/C14H14BrNO2S/c1-11-7-8-13(9-14(11)15)19(17,18)16-10-12-5-3-2-4-6-12/h2-9,16H,10H2,1H3
InChI Key:
UDIVRJRBNLDWNI-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1Br)S(=O)(=O)NCc1ccccc1
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.993g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
340.235g/mol
Monoisotopic Mass:
338.993g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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