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Home > Indoles and Oxindole > 156232-23-4
156232-23-4 | 2H-Indol-2-one, 5-ethoxy-1,3-dihydro-3-(methylthio)-
CAS No: 156232-23-4 Catalog No: AG001OLP MDL No:
Product Description
Catalog Number:
AG001OLP
Chemical Name:
2H-Indol-2-one, 5-ethoxy-1,3-dihydro-3-(methylthio)-
CAS Number:
156232-23-4
Molecular Formula:
C11H13NO2S
Molecular Weight:
223.2914
IUPAC Name:
5-ethoxy-3-methylsulfanyl-1,3-dihydroindol-2-one
InChI:
InChI=1S/C11H13NO2S/c1-3-14-7-4-5-9-8(6-7)10(15-2)11(13)12-9/h4-6,10H,3H2,1-2H3,(H,12,13)
InChI Key:
NINUNIYJMQOZRX-UHFFFAOYSA-N
SMILES:
CCOc1ccc2c(c1)C(SC)C(=O)N2
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.067g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.29g/mol
Monoisotopic Mass:
223.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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