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Home > Indoles and Oxindole > 192928-29-3
192928-29-3 | 2H-Indol-2-one, 1,3-dihydro-3,3-dimethyl-5-(methylsulfonyl)-
CAS No: 192928-29-3 Catalog No: AG0073JK MDL No:
Product Description
Catalog Number:
AG0073JK
Chemical Name:
2H-Indol-2-one, 1,3-dihydro-3,3-dimethyl-5-(methylsulfonyl)-
CAS Number:
192928-29-3
Molecular Formula:
C11H13NO3S
Molecular Weight:
239.2908
IUPAC Name:
3,3-dimethyl-5-methylsulfonyl-1H-indol-2-one
InChI:
InChI=1S/C11H13NO3S/c1-11(2)8-6-7(16(3,14)15)4-5-9(8)12-10(11)13/h4-6H,1-3H3,(H,12,13)
InChI Key:
SEECFDSMFJQZJJ-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1(C)C)cc(cc2)S(=O)(=O)C
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.062g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.289g/mol
Monoisotopic Mass:
239.062g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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