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Home > Indoles and Oxindole > 96202-56-1
96202-56-1 | 1h-indole-2,3-dione, 5-ethyl-
CAS No: 96202-56-1 Catalog No: AG005VCK MDL No:MFCD01132047
Product Description
Catalog Number:
AG005VCK
Chemical Name:
1h-indole-2,3-dione, 5-ethyl-
CAS Number:
96202-56-1
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
MDL Number:
MFCD01132047
IUPAC Name:
5-ethyl-1H-indole-2,3-dione
InChI:
InChI=1S/C10H9NO2/c1-2-6-3-4-8-7(5-6)9(12)10(13)11-8/h3-5H,2H2,1H3,(H,11,12,13)
InChI Key:
XDGNFZUIJHZHHP-UHFFFAOYSA-N
SMILES:
CCc1ccc2c(c1)C(=O)C(=O)N2
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.063g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.187g/mol
Monoisotopic Mass:
175.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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