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Home > Indoles and Oxindole > 81428-01-5
81428-01-5 | 2H-Isoindole-2-ethanesulfonamide, 1,3-dihydro-N-methyl-1,3-dioxo-
CAS No: 81428-01-5 Catalog No: AG00ID6N MDL No:MFCD00717185
Product Description
Catalog Number:
AG00ID6N
Chemical Name:
2H-Isoindole-2-ethanesulfonamide, 1,3-dihydro-N-methyl-1,3-dioxo-
CAS Number:
81428-01-5
Molecular Formula:
C11H12N2O4S
Molecular Weight:
268.2890
MDL Number:
MFCD00717185
IUPAC Name:
2-(1,3-dioxoisoindol-2-yl)-N-methylethanesulfonamide
InChI:
InChI=1S/C11H12N2O4S/c1-12-18(16,17)7-6-13-10(14)8-4-2-3-5-9(8)11(13)15/h2-5,12H,6-7H2,1H3
InChI Key:
CFVLSHVOFAKUNS-UHFFFAOYSA-N
SMILES:
CNS(=O)(=O)CCN1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.052g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
268.287g/mol
Monoisotopic Mass:
268.052g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
91.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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