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Home > Sulfanilamide > 866548-16-5
866548-16-5 | Benzenesulfonamide, 4-methyl-N-1-octynyl-N-2-propenyl-
CAS No: 866548-16-5 Catalog No: AG004OIH MDL No:
Product Description
Catalog Number:
AG004OIH
Chemical Name:
Benzenesulfonamide, 4-methyl-N-1-octynyl-N-2-propenyl-
CAS Number:
866548-16-5
Molecular Formula:
C18H25NO2S
Molecular Weight:
319.4616
IUPAC Name:
4-methyl-N-oct-1-ynyl-N-prop-2-enylbenzenesulfonamide
InChI:
InChI=1S/C18H25NO2S/c1-4-6-7-8-9-10-16-19(15-5-2)22(20,21)18-13-11-17(3)12-14-18/h5,11-14H,2,4,6-9,15H2,1,3H3
InChI Key:
JZKSQVNWLLURSV-UHFFFAOYSA-N
SMILES:
C=CCN(S(=O)(=O)c1ccc(cc1)C)C#CCCCCCC
Properties
Complexity:
484
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.161g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.463g/mol
Monoisotopic Mass:
319.161g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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