1H-Indole-2-carboxylic acid, 3,5-dimethyl-


Chemical Name: 1H-Indole-2-carboxylic acid, 3,5-dimethyl-
CAS Number: 16381-45-6
Product Number: AG001UEV(AGN-PC-0KPXYE)
Synonyms:
MDL No:
Molecular Formula: C11H11NO2
Molecular Weight: 189.2105

Identification/Properties


Computed Properties
Molecular Weight:
189.214g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
189.079g/mol
Monoisotopic Mass:
189.079g/mol
Topological Polar Surface Area:
53.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
241
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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