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1019930-14-3

1019930-14-3 | 2-Pyridinecarboxylic acid, 4-chloro-3-methoxy-6-phenyl-

CAS No: 1019930-14-3 Catalog No: AG000673 MDL No:

Product Description

Catalog Number:
AG000673
Chemical Name:
2-Pyridinecarboxylic acid, 4-chloro-3-methoxy-6-phenyl-
CAS Number:
1019930-14-3
Molecular Formula:
C13H10ClNO3
Molecular Weight:
263.6764
IUPAC Name:
4-chloro-3-methoxy-6-phenylpyridine-2-carboxylic acid
InChI:
InChI=1S/C13H10ClNO3/c1-18-12-9(14)7-10(15-11(12)13(16)17)8-5-3-2-4-6-8/h2-7H,1H3,(H,16,17)
InChI Key:
YRUVREKRTJMCSS-UHFFFAOYSA-N
SMILES:
COc1c(Cl)cc(nc1C(=O)O)c1ccccc1

Properties

Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.035g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
263.677g/mol
Monoisotopic Mass:
263.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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