Home Halogens 5-chloro-4-methyl-1H-indole-2-carboxylic acid

5-chloro-4-methyl-1H-indole-2-carboxylic acid

CAS No.:
50536-61-3
Catalog Number:
AG01DWGH
Molecular Formula:
C10H8ClNO2
Molecular Weight:
209.6290
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Product Description
Catalog Number:
AG01DWGH
Chemical Name:
5-chloro-4-methyl-1H-indole-2-carboxylic acid
CAS Number:
50536-61-3
Molecular Formula:
C10H8ClNO2
Molecular Weight:
209.6290
MDL Number:
MFCD24486051
IUPAC Name:
5-chloro-4-methyl-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C10H8ClNO2/c1-5-6-4-9(10(13)14)12-8(6)3-2-7(5)11/h2-4,12H,1H3,(H,13,14)
InChI Key:
FHGPOPGCRIYJLE-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c([nH]1)ccc(c2C)Cl
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.024g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
209.629g/mol
Monoisotopic Mass:
209.024g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties