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Home > Sulfanilamide > 918943-67-6
918943-67-6 | Benzenesulfonamide, 4-methyl-N-[1-[(1-oxopropoxy)methyl]pentyl]-
CAS No: 918943-67-6 Catalog No: AG006LRL MDL No:
Product Description
Catalog Number:
AG006LRL
Chemical Name:
Benzenesulfonamide, 4-methyl-N-[1-[(1-oxopropoxy)methyl]pentyl]-
CAS Number:
918943-67-6
Molecular Formula:
C16H25NO4S
Molecular Weight:
327.4390
IUPAC Name:
2-[(4-methylphenyl)sulfonylamino]hexyl propanoate
InChI:
InChI=1S/C16H25NO4S/c1-4-6-7-14(12-21-16(18)5-2)17-22(19,20)15-10-8-13(3)9-11-15/h8-11,14,17H,4-7,12H2,1-3H3
InChI Key:
CVVRCEGARLNJDN-UHFFFAOYSA-N
SMILES:
CCCCC(NS(=O)(=O)c1ccc(cc1)C)COC(=O)CC
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.15g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
327.439g/mol
Monoisotopic Mass:
327.15g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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