769151-39-5
1-(2-TETRADECANOYLCARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE
Name1-(2-TETRADECANOYLCARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE
1Identification
【Name】
1-(2-TETRADECANOYLCARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE
【CAS】
【MDL】
MFCD05153687
【English Synonyms】
【Formula】
C33 H42 N2 O4
【MolWeight】
530.705
【Inchi】
InChI=1S/C33H42N2O4/c1-3-4-5-6-7-8-9-10-11-12-13-18-32(36)35-34-25-30-29-17-15-14-16-26(29)21-24-31(30)39-33(37)27-19-22-28(38-2)23-20-27/h14-17,19-25H,3-13,18H2,1-2H3,(H,35,36)/b34-25+
【InChIKey】
InChIKey=FHDSEANTFKBVOK-YQCHCMBFSA-N
【SMILES】
CCCCCCCCCCCCCC(=O)N/N=C/c1c2ccccc2ccc1OC(=O)c3ccc(cc3)OC
【MOL File】
1-(2-TETRADECANOYLCA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:9.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-TETRADECANOYLCARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE.cml