1H-Indole-2-carboxylic acid, 6-bromo-1-methyl-, methyl ester


Chemical Name: 1H-Indole-2-carboxylic acid, 6-bromo-1-methyl-, methyl ester
CAS Number: 680569-18-0
Product Number: AG00FFTU(AGN-PC-0LH59T)
Synonyms:
MDL No:
Molecular Formula: C11H10BrNO2
Molecular Weight: 268.1066

Identification/Properties


Computed Properties
Molecular Weight:
268.11g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
266.98949g/mol
Monoisotopic Mass:
266.98949g/mol
Topological Polar Surface Area:
31.2Ų
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
259
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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