Home Halogens 6-chloro-7-fluoro-1H-indole-2-carboxylic acid

6-chloro-7-fluoro-1H-indole-2-carboxylic acid

CAS No.:
259860-07-6
Catalog Number:
AG01BQ3C
Molecular Formula:
C9H5ClFNO2
Molecular Weight:
213.5929
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Product Description
Catalog Number:
AG01BQ3C
Chemical Name:
6-chloro-7-fluoro-1H-indole-2-carboxylic acid
CAS Number:
259860-07-6
Molecular Formula:
C9H5ClFNO2
Molecular Weight:
213.5929
MDL Number:
MFCD22563677
IUPAC Name:
6-chloro-7-fluoro-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C9H5ClFNO2/c10-5-2-1-4-3-6(9(13)14)12-8(4)7(5)11/h1-3,12H,(H,13,14)
InChI Key:
HRXULQOUYMZDIV-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c([nH]1)c(F)c(cc2)Cl
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.999g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
213.592g/mol
Monoisotopic Mass:
212.999g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties