769148-23-4
5-(BENZOYLOXY)-2-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH BENZOATE
Name5-(BENZOYLOXY)-2-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH BENZOATE
1Identification
【Name】
5-(BENZOYLOXY)-2-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH BENZOATE
【CAS】
【MDL】
MFCD05154185
【English Synonyms】
【Formula】
C35 H25 Cl N2 O6
【MolWeight】
605.044
【Inchi】
InChI=1S/C35H25ClN2O6/c36-29-16-11-24(12-17-29)23-42-30-18-13-25(14-19-30)33(39)38-37-22-28-15-20-31(43-34(40)26-7-3-1-4-8-26)21-32(28)44-35(41)27-9-5-2-6-10-27/h1-22H,23H2,(H,38,39)/b37-22+
【InChIKey】
InChIKey=DBDAWDPRDHGMND-SEBMTOOBSA-N
【SMILES】
c1ccc(cc1)C(=O)Oc2ccc(c(c2)OC(=O)c3ccccc3)/C=N/NC(=O)c4ccc(cc4)OCc5ccc(cc5)Cl
【MOL File】
5-(BENZOYLOXY)-2-(2-….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-(BENZOYLOXY)-2-(2-(4-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PH BENZOATE.cml