769153-99-3
4-(2-DODECANOYLCARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-PHENYLACRYLATE
Name4-(2-DODECANOYLCARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-PHENYLACRYLATE
1Identification
【Name】
4-(2-DODECANOYLCARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-PHENYLACRYLATE
【CAS】
【MDL】
MFCD05153363
【English Synonyms】
【Formula】
C29 H38 N2 O4
【MolWeight】
478.629
【Inchi】
InChI=1S/C29H38N2O4/c1-3-4-5-6-7-8-9-10-14-17-28(32)31-30-23-25-18-20-26(27(22-25)34-2)35-29(33)21-19-24-15-12-11-13-16-24/h11-13,15-16,18-23H,3-10,14,17H2,1-2H3,(H,31,32)/b21-19+,30-23+
【InChIKey】
InChIKey=ALNAAJNEOHLKRE-JASWRBLTSA-N
【SMILES】
CCCCCCCCCCCC(=O)N/N=C/c1ccc(c(c1)OC)OC(=O)/C=C/c2ccccc2
【MOL File】
4-(2-DODECANOYLCARBO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-DODECANOYLCARBOHYDRAZONOYL)-2-METHOXYPHENYL 3-PHENYLACRYLATE.cml