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14192-26-8 | 1H-Indole-6-carboxylic acid, 2,3-dihydro-2-oxo-, methyl ester
CAS No: 14192-26-8 Catalog No: AG001HDX MDL No:MFCD03095196
Product Description
Catalog Number:
AG001HDX
Chemical Name:
1H-Indole-6-carboxylic acid, 2,3-dihydro-2-oxo-, methyl ester
CAS Number:
14192-26-8
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
MDL Number:
MFCD03095196
IUPAC Name:
methyl 2-oxo-1,3-dihydroindole-6-carboxylate
InChI:
InChI=1S/C10H9NO3/c1-14-10(13)7-3-2-6-5-9(12)11-8(6)4-7/h2-4H,5H2,1H3,(H,11,12)
InChI Key:
YFTGUNWFFVDLNM-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)NC(=O)C2
EC Number:
604-263-8
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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