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1016515-54-0 | Benzenesulfonamide, 3-(aminomethyl)-N-butyl-
CAS No: 1016515-54-0 Catalog No: AG00052W MDL No:
Product Description
Catalog Number:
AG00052W
Chemical Name:
Benzenesulfonamide, 3-(aminomethyl)-N-butyl-
CAS Number:
1016515-54-0
Molecular Formula:
C11H18N2O2S
Molecular Weight:
242.3378
IUPAC Name:
3-(aminomethyl)-N-butylbenzenesulfonamide
InChI:
InChI=1S/C11H18N2O2S/c1-2-3-7-13-16(14,15)11-6-4-5-10(8-11)9-12/h4-6,8,13H,2-3,7,9,12H2,1H3
InChI Key:
KJBNLDRJWKVZDD-UHFFFAOYSA-N
SMILES:
CCCCNS(=O)(=O)c1cccc(c1)CN
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.109g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
242.337g/mol
Monoisotopic Mass:
242.109g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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