769147-76-4
4-BR-2-(2-(2-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 4-ETHOXYBENZOATE
Name4-BR-2-(2-(2-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 4-ETHOXYBENZOATE
FormulaC30 H24 Br Cl N2 O5
1Identification
【Name】
4-BR-2-(2-(2-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 4-ETHOXYBENZOATE
【CAS】
【MDL】
MFCD05154219
【English Synonyms】
【Formula】
C30 H24 Br Cl N2 O5
【MolWeight】
607.886
【Inchi】
InChI=1S/C30H24BrClN2O5/c1-2-37-25-14-9-21(10-15-25)30(36)39-27-16-11-23(31)17-22(27)18-33-34-29(35)26-5-3-4-6-28(26)38-19-20-7-12-24(32)13-8-20/h3-18H,2,19H2,1H3,(H,34,35)/b33-18+
【InChIKey】
InChIKey=GKFMVDVQCJGOQM-DPNNOFEESA-N
【SMILES】
CCOc1ccc(cc1)C(=O)Oc2ccc(cc2/C=N/NC(=O)c3ccccc3OCc4ccc(cc4)Cl)Br
【MOL File】
4-BR-2-(2-(2-((4-CHL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-BR-2-(2-(2-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH 4-ETHOXYBENZOATE.cml