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835650-90-3 | Benzenesulfonamide, N-(4-iodo-2-butenyl)-4-methyl-N-2-propenyl-
CAS No: 835650-90-3 Catalog No: AG004UGA MDL No:
Product Description
Catalog Number:
AG004UGA
Chemical Name:
Benzenesulfonamide, N-(4-iodo-2-butenyl)-4-methyl-N-2-propenyl-
CAS Number:
835650-90-3
Molecular Formula:
C14H18INO2S
Molecular Weight:
391.2677
IUPAC Name:
N-(4-iodobut-2-enyl)-4-methyl-N-prop-2-enylbenzenesulfonamide
InChI:
InChI=1S/C14H18INO2S/c1-3-11-16(12-5-4-10-15)19(17,18)14-8-6-13(2)7-9-14/h3-9H,1,10-12H2,2H3
InChI Key:
FIDYZYHAAGMYMG-UHFFFAOYSA-N
SMILES:
ICC=CCN(S(=O)(=O)c1ccc(cc1)C)CC=C
Properties
Complexity:
392
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
391.01g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
391.267g/mol
Monoisotopic Mass:
391.01g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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