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Home > Indoles and Oxindole > 59868-38-1
59868-38-1 | 6-(ethylsulfanyl)-2,3-dihydro-1H-indole-2,3-dione
CAS No: 59868-38-1 Catalog No: AG019ZPD MDL No:MFCD12143533
Product Description
Catalog Number:
AG019ZPD
Chemical Name:
6-(ethylsulfanyl)-2,3-dihydro-1H-indole-2,3-dione
CAS Number:
59868-38-1
Molecular Formula:
C10H9NO2S
Molecular Weight:
207.2490
MDL Number:
MFCD12143533
IUPAC Name:
6-ethylsulfanyl-1H-indole-2,3-dione
InChI:
InChI=1S/C10H9NO2S/c1-2-14-6-3-4-7-8(5-6)11-10(13)9(7)12/h3-5H,2H2,1H3,(H,11,12,13)
InChI Key:
FGVIVDHQEMLTBB-UHFFFAOYSA-N
SMILES:
CCSc1ccc2c(c1)NC(=O)C2=O
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.035g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.247g/mol
Monoisotopic Mass:
207.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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