Home Carboxys 4-Chloro-5-Methoxy-pyridine-2-carboxylic acid

4-Chloro-5-Methoxy-pyridine-2-carboxylic acid

CAS No.:
103878-33-7
Catalog Number:
AG00958Z
Molecular Formula:
C7H6ClNO3
Molecular Weight:
187.5804
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Product Description
Catalog Number:
AG00958Z
Chemical Name:
4-Chloro-5-Methoxy-pyridine-2-carboxylic acid
CAS Number:
103878-33-7
Molecular Formula:
C7H6ClNO3
Molecular Weight:
187.5804
IUPAC Name:
4-chloro-5-methoxypyridine-2-carboxylic acid
InChI:
InChI=1S/C7H6ClNO3/c1-12-6-3-9-5(7(10)11)2-4(6)8/h2-3H,1H3,(H,10,11)
InChI Key:
PCBUUNZNBZYPNJ-UHFFFAOYSA-N
SMILES:
COc1cnc(cc1Cl)C(=O)O
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.004g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.579g/mol
Monoisotopic Mass:
187.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties