198213-15-9
1,2,5,6-TETRAHYDRO-4-HYDROXY-2-OXO-3-PYRIDINECARBOXYLIC ACID METHYL ESTER SODIUM SALT
Name1,2,5,6-TETRAHYDRO-4-HYDROXY-2-OXO-3-PYRIDINECARBOXYLIC ACID METHYL ESTER SODIUM SALT
1Identification
【Name】
1,2,5,6-TETRAHYDRO-4-HYDROXY-2-OXO-3-PYRIDINECARBOXYLIC ACID METHYL ESTER SODIUM SALT
【CAS】
【MDL】
MFCD09859707
【English Synonyms】
【Formula】
C7 H8 N O4 . Na
【MolWeight】
193.133
【Inchi】
InChI=1S/C7H9NO4.Na/c1-12-7(11)5-4(9)2-3-8-6(5)10;/h9H,2-3H2,1H3,(H,8,10);/q;+1/p-1
【InChIKey】
InChIKey=SGWFJDMPYNZBFZ-UHFFFAOYSA-M
【SMILES】
COC(=O)C1=C(CCNC1=O)[O-].[Na+]
【MOL File】
1,2,5,6-TETRAHYDRO-4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2,5,6-TETRAHYDRO-4-HYDROXY-2-OXO-3-PYRIDINECARBOXYLIC ACID METHYL ESTER SODIUM SALT.cml