Home Halogens 5-chloro-4-methylpyridine-3-carboxylic acid

5-chloro-4-methylpyridine-3-carboxylic acid

CAS No.:
890092-41-8
Catalog Number:
AG01AFB4
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
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Product Description
Catalog Number:
AG01AFB4
Chemical Name:
5-chloro-4-methylpyridine-3-carboxylic acid
CAS Number:
890092-41-8
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
MDL Number:
MFCD07439972
IUPAC Name:
5-chloro-4-methylpyridine-3-carboxylic acid
InChI:
InChI=1S/C7H6ClNO2/c1-4-5(7(10)11)2-9-3-6(4)8/h2-3H,1H3,(H,10,11)
InChI Key:
DNYPAJVKUAHQHN-UHFFFAOYSA-N
SMILES:
OC(=O)c1cncc(c1C)Cl
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:
1.4  
Properties