769149-84-0
4-(2-(4-(ALLYLOXY)BENZOYL)CARBOHYDRAZONOYL)-2-ETHOXYPHENYL 4-METHOXYBENZOATE
Name4-(2-(4-(ALLYLOXY)BENZOYL)CARBOHYDRAZONOYL)-2-ETHOXYPHENYL 4-METHOXYBENZOATE
1Identification
【Name】
4-(2-(4-(ALLYLOXY)BENZOYL)CARBOHYDRAZONOYL)-2-ETHOXYPHENYL 4-METHOXYBENZOATE
【CAS】
【MDL】
MFCD05154030
【English Synonyms】
【Formula】
C27 H26 N2 O6
【MolWeight】
474.51
【Inchi】
InChI=1S/C27H26N2O6/c1-4-16-34-23-13-7-20(8-14-23)26(30)29-28-18-19-6-15-24(25(17-19)33-5-2)35-27(31)21-9-11-22(32-3)12-10-21/h4,6-15,17-18H,1,5,16H2,2-3H3,(H,29,30)/b28-18+
【InChIKey】
InChIKey=ZAWMWLAASOSFDX-MTDXEUNCSA-N
【SMILES】
CCOc1cc(ccc1OC(=O)c2ccc(cc2)OC)/C=N/NC(=O)c3ccc(cc3)OCC=C
【MOL File】
4-(2-(4-(ALLYLOXY)BE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-(4-(ALLYLOXY)BENZOYL)CARBOHYDRAZONOYL)-2-ETHOXYPHENYL 4-METHOXYBENZOATE.cml