769151-93-1
5-((4-CHLOROBENZOYL)OXY)-2-(2-TETRADECANOYLCARBOHYDRAZONOYL)PH 4-CHLOROBENZOATE
Name5-((4-CHLOROBENZOYL)OXY)-2-(2-TETRADECANOYLCARBOHYDRAZONOYL)PH 4-CHLOROBENZOATE
1Identification
【Name】
5-((4-CHLOROBENZOYL)OXY)-2-(2-TETRADECANOYLCARBOHYDRAZONOYL)PH 4-CHLOROBENZOATE
【CAS】
【MDL】
MFCD05153610
【English Synonyms】
【Formula】
C35 H40 Cl2 N2 O5
【MolWeight】
639.616
【Inchi】
InChI=1S/C35H40Cl2N2O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-33(40)39-38-25-28-18-23-31(43-34(41)26-14-19-29(36)20-15-26)24-32(28)44-35(42)27-16-21-30(37)22-17-27/h14-25H,2-13H2,1H3,(H,39,40)/b38-25+
【InChIKey】
InChIKey=NOVGGSXRJLZWOK-XPGZBYHPSA-N
【SMILES】
CCCCCCCCCCCCCC(=O)N/N=C/c1ccc(cc1OC(=O)c2ccc(cc2)Cl)OC(=O)c3ccc(cc3)Cl
【MOL File】
5-((4-CHLOROBENZOYL)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:10.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-((4-CHLOROBENZOYL)OXY)-2-(2-TETRADECANOYLCARBOHYDRAZONOYL)PH 4-CHLOROBENZOATE.cml