1H-Indole-3-carboxylic acid, 5-(acetyloxy)-1,2-dimethyl-, ethyl ester


Chemical Name: 1H-Indole-3-carboxylic acid, 5-(acetyloxy)-1,2-dimethyl-, ethyl ester
CAS Number: 40945-79-7
Product Number: AG00BXIC(AGN-PC-0JNGIG)
Synonyms:
MDL No:
Molecular Formula: C15H17NO4
Molecular Weight: 275.29978

Identification/Properties


Computed Properties
Molecular Weight:
275.304g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
275.116g/mol
Monoisotopic Mass:
275.116g/mol
Topological Polar Surface Area:
57.5A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
384
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

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NMR Spectrum


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