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Home > Sulfanilamide > 831225-94-6
831225-94-6 | Benzenesulfonamide, 2,4,6-tris(1-methylethyl)-N-(phenylmethylene)-
CAS No: 831225-94-6 Catalog No: AG004W3F MDL No:
Product Description
Catalog Number:
AG004W3F
Chemical Name:
Benzenesulfonamide, 2,4,6-tris(1-methylethyl)-N-(phenylmethylene)-
CAS Number:
831225-94-6
Molecular Formula:
C22H29NO2S
Molecular Weight:
371.5362
IUPAC Name:
N-benzylidene-2,4,6-tri(propan-2-yl)benzenesulfonamide
InChI:
InChI=1S/C22H29NO2S/c1-15(2)19-12-20(16(3)4)22(21(13-19)17(5)6)26(24,25)23-14-18-10-8-7-9-11-18/h7-17H,1-6H3
InChI Key:
OQRGWAXFIHYXCN-UHFFFAOYSA-N
SMILES:
CC(c1cc(cc(c1S(=O)(=O)N=Cc1ccccc1)C(C)C)C(C)C)C
Properties
Complexity:
535
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
371.192g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
371.539g/mol
Monoisotopic Mass:
371.192g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
6.2
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