1H-Indole-5-carboxylic acid, 1-acetyl-2,3-dihydro-2-oxo-, methyl ester


Chemical Name: 1H-Indole-5-carboxylic acid, 1-acetyl-2,3-dihydro-2-oxo-, methyl ester
CAS Number: 247082-83-3
Product Number: AG002P4S(AGN-PC-01YVOL)
Synonyms:
MDL No:
Molecular Formula: C12H11NO4
Molecular Weight: 233.2200

Identification/Properties


Computed Properties
Molecular Weight:
233.223g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
233.069g/mol
Monoisotopic Mass:
233.069g/mol
Topological Polar Surface Area:
63.7A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
366
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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