Home Halogens 4,6-dichloro-3-methyl-1H-indole-2-carboxylic acid

4,6-dichloro-3-methyl-1H-indole-2-carboxylic acid

CAS No.:
441801-00-9
Catalog Number:
AG01DWFS
Molecular Formula:
C10H7Cl2NO2
Molecular Weight:
244.0741
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Product Description
Catalog Number:
AG01DWFS
Chemical Name:
4,6-dichloro-3-methyl-1H-indole-2-carboxylic acid
CAS Number:
441801-00-9
Molecular Formula:
C10H7Cl2NO2
Molecular Weight:
244.0741
MDL Number:
MFCD20227254
IUPAC Name:
4,6-dichloro-3-methyl-1H-indole-2-carboxylic acid
InChI:
InChI=1S/C10H7Cl2NO2/c1-4-8-6(12)2-5(11)3-7(8)13-9(4)10(14)15/h2-3,13H,1H3,(H,14,15)
InChI Key:
WPRCUFHYPTYFBP-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)c2c(c1)[nH]c(c2C)C(=O)O
Properties
Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.985g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
244.071g/mol
Monoisotopic Mass:
242.985g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties