Home Carboxys 3-Pyridinecarboxylic acid, 6-[(acetyloxy)methyl]-, methyl ester

3-Pyridinecarboxylic acid, 6-[(acetyloxy)methyl]-, methyl ester

CAS No.:
63362-34-5
Catalog Number:
AG00IB78
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
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Product Description
Catalog Number:
AG00IB78
Chemical Name:
3-Pyridinecarboxylic acid, 6-[(acetyloxy)methyl]-, methyl ester
CAS Number:
63362-34-5
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
MDL Number:
MFCD28157745
IUPAC Name:
methyl 6-(acetyloxymethyl)pyridine-3-carboxylate
InChI:
InChI=1S/C10H11NO4/c1-7(12)15-6-9-4-3-8(5-11-9)10(13)14-2/h3-5H,6H2,1-2H3
InChI Key:
WUWLMSMOILJHBX-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(nc1)COC(=O)C
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.201g/mol
Monoisotopic Mass:
209.069g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties