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Home > Sulfanilamide > 89313-03-1
89313-03-1 | Benzenesulfonamide, N-butyl-4-(2-oxopropyl)-
CAS No: 89313-03-1 Catalog No: AG0040FM MDL No:
Product Description
Catalog Number:
AG0040FM
Chemical Name:
Benzenesulfonamide, N-butyl-4-(2-oxopropyl)-
CAS Number:
89313-03-1
Molecular Formula:
C13H19NO3S
Molecular Weight:
269.3599
IUPAC Name:
N-butyl-4-(2-oxopropyl)benzenesulfonamide
InChI:
InChI=1S/C13H19NO3S/c1-3-4-9-14-18(16,17)13-7-5-12(6-8-13)10-11(2)15/h5-8,14H,3-4,9-10H2,1-2H3
InChI Key:
MRXQGBFLFQSCCH-UHFFFAOYSA-N
SMILES:
CCCCNS(=O)(=O)c1ccc(cc1)CC(=O)C
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.109g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.359g/mol
Monoisotopic Mass:
269.109g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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