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847204-03-9 | Benzenesulfonamide, N-[(2E)-2-formyl-1-phenyl-2-butenyl]-4-methyl-
CAS No: 847204-03-9 Catalog No: AG004SDF MDL No:
Product Description
Catalog Number:
AG004SDF
Chemical Name:
Benzenesulfonamide, N-[(2E)-2-formyl-1-phenyl-2-butenyl]-4-methyl-
CAS Number:
847204-03-9
Molecular Formula:
C18H19NO3S
Molecular Weight:
329.4134
IUPAC Name:
N-(2-formyl-1-phenylbut-2-enyl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C18H19NO3S/c1-3-15(13-20)18(16-7-5-4-6-8-16)19-23(21,22)17-11-9-14(2)10-12-17/h3-13,18-19H,1-2H3
InChI Key:
JBQKTHHWVISPBS-UHFFFAOYSA-N
SMILES:
C/C=C(\C(c1ccccc1)NS(=O)(=O)c1ccc(cc1)C)/C=O
Properties
Complexity:
507
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.109g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
329.414g/mol
Monoisotopic Mass:
329.109g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.1
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