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1256834-59-9

1256834-59-9 | 3-Pyridinecarboxylic acid, 2-chloro-5-hydroxy-, methyl ester

CAS No: 1256834-59-9 Catalog No: AG000OGG MDL No:MFCD18256809

Product Description

Catalog Number:
AG000OGG
Chemical Name:
3-Pyridinecarboxylic acid, 2-chloro-5-hydroxy-, methyl ester
CAS Number:
1256834-59-9
Molecular Formula:
C7H6ClNO3
Molecular Weight:
187.5804
MDL Number:
MFCD18256809
IUPAC Name:
methyl 2-chloro-5-hydroxypyridine-3-carboxylate
InChI:
InChI=1S/C7H6ClNO3/c1-12-7(11)5-2-4(10)3-9-6(5)8/h2-3,10H,1H3
InChI Key:
ZBTMUCZLAPHKSS-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(O)cnc1Cl

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  

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