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26156-51-4 | 4-Pyridinecarboxylic acid, 2-methoxy-, methyl ester
CAS No: 26156-51-4 Catalog No: AG002RWK MDL No:MFCD08436071
Product Description
Catalog Number:
AG002RWK
Chemical Name:
4-Pyridinecarboxylic acid, 2-methoxy-, methyl ester
CAS Number:
26156-51-4
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD08436071
IUPAC Name:
methyl 2-methoxypyridine-4-carboxylate
InChI:
InChI=1S/C8H9NO3/c1-11-7-5-6(3-4-9-7)8(10)12-2/h3-5H,1-2H3
InChI Key:
KVFSHVOCUQNUNV-UHFFFAOYSA-N
SMILES:
COc1nccc(c1)C(=O)OC
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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