767312-51-6
2-METHOXY-4-(2-PALMITOYLCARBOHYDRAZONOYL)PHENYL 4-BUTOXYBENZOATE
Name2-METHOXY-4-(2-PALMITOYLCARBOHYDRAZONOYL)PHENYL 4-BUTOXYBENZOATE
1Identification
【Name】
2-METHOXY-4-(2-PALMITOYLCARBOHYDRAZONOYL)PHENYL 4-BUTOXYBENZOATE
【CAS】
【MDL】
MFCD05720795
【English Synonyms】
【Formula】
C35 H52 N2 O5
【MolWeight】
580.805
【Inchi】
InChI=1S/C35H52N2O5/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-34(38)37-36-28-29-20-25-32(33(27-29)40-3)42-35(39)30-21-23-31(24-22-30)41-26-7-5-2/h20-25,27-28H,4-19,26H2,1-3H3,(H,37,38)/b36-28+
【InChIKey】
InChIKey=NHDASPUJHMXBOR-FDEZRRJOSA-N
【SMILES】
CCCCCCCCCCCCCCCC(=O)N/N=C/c1ccc(c(c1)OC)OC(=O)c2ccc(cc2)OCCCC
【MOL File】
2-METHOXY-4-(2-PALMI….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
2-METHOXY-4-(2-PALMITOYLCARBOHYDRAZONOYL)PHENYL 4-BUTOXYBENZOATE.cml