1-ethyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid


Chemical Name: 1-ethyl-5-methoxy-2-methyl-1H-indole-3-carboxylic acid
CAS Number: 100372-60-9
Product Number: AG01AA7R(AG01AA7R)
Synonyms:
MDL No:
Molecular Formula: C13H15NO3
Molecular Weight: 233.2631

Identification/Properties


Computed Properties
Molecular Weight:
233.267g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
233.105g/mol
Monoisotopic Mass:
233.105g/mol
Topological Polar Surface Area:
51.5A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
294
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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