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1263282-64-9 | 1H-Indole-6-carboxylic acid, 2,3-dihydro-2,3-dioxo-, ethyl ester
CAS No: 1263282-64-9 Catalog No: AG000SLO MDL No:
Product Description
Catalog Number:
AG000SLO
Chemical Name:
1H-Indole-6-carboxylic acid, 2,3-dihydro-2,3-dioxo-, ethyl ester
CAS Number:
1263282-64-9
Molecular Formula:
C11H9NO4
Molecular Weight:
219.1935
IUPAC Name:
ethyl 2,3-dioxo-1H-indole-6-carboxylate
InChI:
InChI=1S/C11H9NO4/c1-2-16-11(15)6-3-4-7-8(5-6)12-10(14)9(7)13/h3-5H,2H2,1H3,(H,12,13,14)
InChI Key:
QAXBICCSIPFOSD-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc2c(c1)NC(=O)C2=O
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.053g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.196g/mol
Monoisotopic Mass:
219.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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