769152-57-0
4-BR-2-(2-(4-((4-METHYLBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE
Name4-BR-2-(2-(4-((4-METHYLBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE
1Identification
【Name】
4-BR-2-(2-(4-((4-METHYLBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE
【CAS】
【MDL】
MFCD05153524
【English Synonyms】
【Formula】
C32 H29 Br N2 O5
【MolWeight】
601.494
【Inchi】
InChI=1S/C32H29BrN2O5/c1-3-18-38-28-15-10-25(11-16-28)32(37)40-30-17-12-27(33)19-26(30)20-34-35-31(36)24-8-13-29(14-9-24)39-21-23-6-4-22(2)5-7-23/h4-17,19-20H,3,18,21H2,1-2H3,(H,35,36)/b34-20+
【InChIKey】
InChIKey=MAQUGUTUEQAYNK-QXUDOOCXSA-N
【SMILES】
CCCOc1ccc(cc1)C(=O)Oc2ccc(cc2/C=N/NC(=O)c3ccc(cc3)OCc4ccc(cc4)C)Br
【MOL File】
4-BR-2-(2-(4-((4-MET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:8.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-BR-2-(2-(4-((4-METHYLBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 4-PROPOXYBENZOATE.cml