765913-22-2
1-(2-((TETRADECANOYLAMINO)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
Name1-(2-((TETRADECANOYLAMINO)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
1Identification
【Name】
1-(2-((TETRADECANOYLAMINO)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE
【CAS】
【MDL】
MFCD05154528
【English Synonyms】
【Formula】
C36 H47 N3 O6
【MolWeight】
617.782
【Inchi】
InChI=1S/C36H47N3O6/c1-4-5-6-7-8-9-10-11-12-13-14-19-34(40)37-26-35(41)39-38-25-30-29-18-16-15-17-27(29)20-22-31(30)45-36(42)28-21-23-32(43-2)33(24-28)44-3/h15-18,20-25H,4-14,19,26H2,1-3H3,(H,37,40)(H,39,41)/b38-25+
【InChIKey】
InChIKey=QHBIBURMEVXLRB-XPGZBYHPSA-N
【SMILES】
CCCCCCCCCCCCCC(=O)NCC(=O)N/N=C/c1c2ccccc2ccc1OC(=O)c3ccc(c(c3)OC)OC
【MOL File】
1-(2-((TETRADECANOYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:9
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-((TETRADECANOYLAMINO)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 3,4-DIMETHOXYBENZOATE.cml