3-CHLORO-1H-INDOLE-2-CARBOXYLIC ACID METHYL ESTER


Chemical Name: 3-CHLORO-1H-INDOLE-2-CARBOXYLIC ACID METHYL ESTER
CAS Number: 220664-32-4
Product Number: AG00C1C0(AGN-PC-0WAL1Q)
Synonyms:
MDL No:
Molecular Formula: C10H8ClNO2
Molecular Weight: 209.6290

Identification/Properties


Computed Properties
Molecular Weight:
209.629g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
209.024g/mol
Monoisotopic Mass:
209.024g/mol
Topological Polar Surface Area:
42.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
234
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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