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Home > Sulfanilamide > 18963-39-8
18963-39-8 | Benzenesulfonamide, N-phenyl-2-(2-phenylethynyl)-
CAS No: 18963-39-8 Catalog No: AG002DUI MDL No:
Product Description
Catalog Number:
AG002DUI
Chemical Name:
Benzenesulfonamide, N-phenyl-2-(2-phenylethynyl)-
CAS Number:
18963-39-8
Molecular Formula:
C20H15NO2S
Molecular Weight:
333.4036
IUPAC Name:
N-phenyl-2-(2-phenylethynyl)benzenesulfonamide
InChI:
InChI=1S/C20H15NO2S/c22-24(23,21-19-12-5-2-6-13-19)20-14-8-7-11-18(20)16-15-17-9-3-1-4-10-17/h1-14,21H
InChI Key:
FVTQIRKCWGXXGI-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1C#Cc1ccccc1)Nc1ccccc1
NSC Number:
117898
Properties
Complexity:
553
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.082g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
333.405g/mol
Monoisotopic Mass:
333.082g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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