Home Carboxys 4-Chloro-5-Methyl-2-pyridinecarboxylic acid

4-Chloro-5-Methyl-2-pyridinecarboxylic acid

CAS No.:
882679-14-3
Catalog Number:
AG00H10R
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
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Product Description
Catalog Number:
AG00H10R
Chemical Name:
4-Chloro-5-Methyl-2-pyridinecarboxylic acid
CAS Number:
882679-14-3
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
MDL Number:
MFCD12400883
IUPAC Name:
4-chloro-5-methylpyridine-2-carboxylic acid
InChI:
InChI=1S/C7H6ClNO2/c1-4-3-9-6(7(10)11)2-5(4)8/h2-3H,1H3,(H,10,11)
InChI Key:
IIYOXHJTMDXVMM-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncc(c(c1)Cl)C
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.009g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
171.58g/mol
Monoisotopic Mass:
171.009g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties