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116526-91-1 | 1-Hexadecanesulfonamide, N-(4-chlorophenyl)-
CAS No: 116526-91-1 Catalog No: AG000COH MDL No:
Product Description
Catalog Number:
AG000COH
Chemical Name:
1-Hexadecanesulfonamide, N-(4-chlorophenyl)-
CAS Number:
116526-91-1
Molecular Formula:
C22H38ClNO2S
Molecular Weight:
416.0606
IUPAC Name:
N-(4-chlorophenyl)hexadecane-1-sulfonamide
InChI:
InChI=1S/C22H38ClNO2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-27(25,26)24-22-18-16-21(23)17-19-22/h16-19,24H,2-15,20H2,1H3
InChI Key:
WKTLHEOMIPXSBV-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCS(=O)(=O)Nc1ccc(cc1)Cl
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
415.231g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
416.061g/mol
Monoisotopic Mass:
415.231g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.3
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