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Home > Indoles and Oxindole > 88426-94-2
88426-94-2 | 2H-Indol-2-one, 1,3-dihydro-3-(2-hydroxyethyl)-3-methyl-
CAS No: 88426-94-2 Catalog No: AG004KFT MDL No:
Product Description
Catalog Number:
AG004KFT
Chemical Name:
2H-Indol-2-one, 1,3-dihydro-3-(2-hydroxyethyl)-3-methyl-
CAS Number:
88426-94-2
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
IUPAC Name:
3-(2-hydroxyethyl)-3-methyl-1H-indol-2-one
InChI:
InChI=1S/C11H13NO2/c1-11(6-7-13)8-4-2-3-5-9(8)12-10(11)14/h2-5,13H,6-7H2,1H3,(H,12,14)
InChI Key:
SSSZTLCHRYMYAC-UHFFFAOYSA-N
SMILES:
OCCC1(C)C(=O)Nc2c1cccc2
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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