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88314-30-1 | Methanesulfonamide, N-[3-[bis(3-chloro-2-propenyl)amino]phenyl]-
CAS No: 88314-30-1 Catalog No: AG0048OU MDL No:
Product Description
Catalog Number:
AG0048OU
Chemical Name:
Methanesulfonamide, N-[3-[bis(3-chloro-2-propenyl)amino]phenyl]-
CAS Number:
88314-30-1
Molecular Formula:
C13H16Cl2N2O2S
Molecular Weight:
335.2493
IUPAC Name:
N-[3-[bis(3-chloroprop-2-enyl)amino]phenyl]methanesulfonamide
InChI:
InChI=1S/C13H16Cl2N2O2S/c1-20(18,19)16-12-5-2-6-13(11-12)17(9-3-7-14)10-4-8-15/h2-8,11,16H,9-10H2,1H3
InChI Key:
WXGCPAXODKITSI-UHFFFAOYSA-N
SMILES:
ClC=CCN(c1cccc(c1)NS(=O)(=O)C)CC=CCl
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.031g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
335.243g/mol
Monoisotopic Mass:
334.031g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
2.9
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