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1312903-94-8 | 2-Pyridinecarboxylic acid, 5-ethoxy-, ethyl ester
CAS No: 1312903-94-8 Catalog No: AG000VVM MDL No:MFCD23135680
Product Description
Catalog Number:
AG000VVM
Chemical Name:
2-Pyridinecarboxylic acid, 5-ethoxy-, ethyl ester
CAS Number:
1312903-94-8
Molecular Formula:
C10H13NO3
Molecular Weight:
195.2151
MDL Number:
MFCD23135680
IUPAC Name:
ethyl 5-ethoxypyridine-2-carboxylate
InChI:
InChI=1S/C10H13NO3/c1-3-13-8-5-6-9(11-7-8)10(12)14-4-2/h5-7H,3-4H2,1-2H3
InChI Key:
GURVKDSNNLEJBB-UHFFFAOYSA-N
SMILES:
CCOc1ccc(nc1)C(=O)OCC
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.218g/mol
Monoisotopic Mass:
195.09g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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