1H-Indole-2-carboxylic acid, 7-bromo-, ethyl ester


Chemical Name: 1H-Indole-2-carboxylic acid, 7-bromo-, ethyl ester
CAS Number: 16732-69-7
Product Number: AG001XAS(AGN-PC-0LW7X1)
Synonyms:
MDL No:
Molecular Formula: C11H10BrNO2
Molecular Weight: 268.1066

Identification/Properties


Computed Properties
Molecular Weight:
268.11g/mol
XLogP3:
3.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
266.989g/mol
Monoisotopic Mass:
266.989g/mol
Topological Polar Surface Area:
42.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
247
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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