1H-Indole-6-carboxylic acid, 2,3-dihydro-2-oxo-, methyl ester


Chemical Name: 1H-Indole-6-carboxylic acid, 2,3-dihydro-2-oxo-, methyl ester
CAS Number: 14192-26-8
Product Number: AG001HDX(AGN-PC-0KZBFK)
Synonyms:
MDL No: MFCD03095196
Molecular Formula: C10H9NO3
Molecular Weight: 191.1834

Identification/Properties


Properties
MP:
184-190 °C
BP:
388.1°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
191.186g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
191.058g/mol
Monoisotopic Mass:
191.058g/mol
Topological Polar Surface Area:
55.4A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
264
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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