129477-57-2
HEXYL 1,4-BIS(3,4,5-TRIMETHOXYBENZOYL)-2-PIPERAZINECARBOXYLATE
NameHEXYL 1,4-BIS(3,4,5-TRIMETHOXYBENZOYL)-2-PIPERAZINECARBOXYLATE
1Identification
【Name】
HEXYL 1,4-BIS(3,4,5-TRIMETHOXYBENZOYL)-2-PIPERAZINECARBOXYLATE
【CAS】
【MDL】
MFCD00891336
【English Synonyms】
【Formula】
C31 H42 N2 O10
【MolWeight】
602.677
【Inchi】
InChI=1S/C31H42N2O10/c1-8-9-10-11-14-43-31(36)22-19-32(29(34)20-15-23(37-2)27(41-6)24(16-20)38-3)12-13-33(22)30(35)21-17-25(39-4)28(42-7)26(18-21)40-5/h15-18,22H,8-14,19H2,1-7H3
【InChIKey】
InChIKey=XBEQXYIHPVWOBO-UHFFFAOYSA-N
【SMILES】
CCCCCCOC(=O)C1CN(CCN1C(=O)c2cc(c(c(c2)OC)OC)OC)C(=O)c3cc(c(c(c3)OC)OC)OC
【MOL File】
HEXYL 1,4-BIS(3,4,5-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:12
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
HEXYL 1,4-BIS(3,4,5-TRIMETHOXYBENZOYL)-2-PIPERAZINECARBOXYLATE.cml