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257953-10-9 | 2,5-dimethyl-N-propylbenzene-1-sulfonamide
CAS No: 257953-10-9 Catalog No: AG019OXV MDL No:MFCD04636897
Product Description
Catalog Number:
AG019OXV
Chemical Name:
2,5-dimethyl-N-propylbenzene-1-sulfonamide
CAS Number:
257953-10-9
Molecular Formula:
C11H17NO2S
Molecular Weight:
227.3232
MDL Number:
MFCD04636897
IUPAC Name:
2,5-dimethyl-N-propylbenzenesulfonamide
InChI:
InChI=1S/C11H17NO2S/c1-4-7-12-15(13,14)11-8-9(2)5-6-10(11)3/h5-6,8,12H,4,7H2,1-3H3
InChI Key:
FRXQEIXUBGNNCH-UHFFFAOYSA-N
SMILES:
CCCNS(=O)(=O)c1cc(C)ccc1C
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.098g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.322g/mol
Monoisotopic Mass:
227.098g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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