764653-73-8
5-((4-CHLOROBENZOYL)OXY)-2-(2-(4-ETHOXYBENZOYL)CARBOHYDRAZONOYL)PH 4-CL-BENZOATE
Name5-((4-CHLOROBENZOYL)OXY)-2-(2-(4-ETHOXYBENZOYL)CARBOHYDRAZONOYL)PH 4-CL-BENZOATE
1Identification
【Name】
5-((4-CHLOROBENZOYL)OXY)-2-(2-(4-ETHOXYBENZOYL)CARBOHYDRAZONOYL)PH 4-CL-BENZOATE
【CAS】
【MDL】
MFCD05720384
【English Synonyms】
【Formula】
C30 H22 Cl2 N2 O6
【MolWeight】
577.418
【Inchi】
InChI=1S/C30H22Cl2N2O6/c1-2-38-25-14-7-19(8-15-25)28(35)34-33-18-22-9-16-26(39-29(36)20-3-10-23(31)11-4-20)17-27(22)40-30(37)21-5-12-24(32)13-6-21/h3-18H,2H2,1H3,(H,34,35)/b33-18+
【InChIKey】
InChIKey=UFRJCVTVHSPCGM-DPNNOFEESA-N
【SMILES】
CCOc1ccc(cc1)C(=O)N/N=C/c2ccc(cc2OC(=O)c3ccc(cc3)Cl)OC(=O)c4ccc(cc4)Cl
【MOL File】
5-((4-CHLOROBENZOYL)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-((4-CHLOROBENZOYL)OXY)-2-(2-(4-ETHOXYBENZOYL)CARBOHYDRAZONOYL)PH 4-CL-BENZOATE.cml