769153-39-1
2-MEO-4-(2-(4-((4-METHYLBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE
Name2-MEO-4-(2-(4-((4-METHYLBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE
1Identification
【Name】
2-MEO-4-(2-(4-((4-METHYLBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE
【CAS】
【MDL】
MFCD05153430
【English Synonyms】
【Formula】
C33 H32 N2 O6
【MolWeight】
552.624
【Inchi】
InChI=1S/C33H32N2O6/c1-4-19-39-28-16-12-27(13-17-28)33(37)41-30-18-9-25(20-31(30)38-3)21-34-35-32(36)26-10-14-29(15-11-26)40-22-24-7-5-23(2)6-8-24/h5-18,20-21H,4,19,22H2,1-3H3,(H,35,36)/b34-21+
【InChIKey】
InChIKey=KTMLQNLYKCFKAD-KEIPNQJHSA-N
【SMILES】
CCCOc1ccc(cc1)C(=O)Oc2ccc(cc2OC)/C=N/NC(=O)c3ccc(cc3)OCc4ccc(cc4)C
【MOL File】
2-MEO-4-(2-(4-((4-ME….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
2-MEO-4-(2-(4-((4-METHYLBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE.cml