26502-58-9
1-(4-ETHOXY-PHENYL)-4-HYDROXY-1H-PYRAZOLE-3-CARBOXYLIC ACID ETHYL ESTER
Name1-(4-ETHOXY-PHENYL)-4-HYDROXY-1H-PYRAZOLE-3-CARBOXYLIC ACID ETHYL ESTER
1Identification
【Name】
1-(4-ETHOXY-PHENYL)-4-HYDROXY-1H-PYRAZOLE-3-CARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD02361223
【English Synonyms】
【Formula】
C14 H16 N2 O4
【MolWeight】
276.29
【Inchi】
InChI=1S/C14H16N2O4/c1-3-19-11-7-5-10(6-8-11)16-9-12(17)13(15-16)14(18)20-4-2/h5-9,17H,3-4H2,1-2H3
【InChIKey】
InChIKey=LTNGQELIESBHOI-UHFFFAOYSA-N
【SMILES】
CCOc1ccc(cc1)n2cc(c(n2)C(=O)OCC)O
【MOL File】
1-(4-ETHOXY-PHENYL)-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(4-ETHOXY-PHENYL)-4-HYDROXY-1H-PYRAZOLE-3-CARBOXYLIC ACID ETHYL ESTER.cml