55267-67-9
6-CYANO-5-METHYL-2-PYRIDINECARBOXYLIC ACID METHYL ESTER
Name6-CYANO-5-METHYL-2-PYRIDINECARBOXYLIC ACID METHYL ESTER
1Identification
【Name】
6-CYANO-5-METHYL-2-PYRIDINECARBOXYLIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD19690499
【English Synonyms】
【Formula】
C9 H8 N2 O2
【MolWeight】
176.174
【Inchi】
InChI=1S/C9H8N2O2/c1-6-3-4-7(9(12)13-2)11-8(6)5-10/h3-4H,1-2H3
【InChIKey】
InChIKey=ASQMBFYBRDHRSO-UHFFFAOYSA-N
【SMILES】
Cc1ccc(nc1C#N)C(=O)OC
【MOL File】
6-CYANO-5-METHYL-2-P….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
6-CYANO-5-METHYL-2-PYRIDINECARBOXYLIC ACID METHYL ESTER.cml