767339-42-4
4-(2-NONANOYLCARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE
Name4-(2-NONANOYLCARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE
1Identification
【Name】
4-(2-NONANOYLCARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE
【CAS】
【MDL】
MFCD05151980
【English Synonyms】
【Formula】
C23 H26 Cl2 N2 O3
【MolWeight】
449.375
【Inchi】
InChI=1S/C23H26Cl2N2O3/c1-2-3-4-5-6-7-8-22(28)27-26-16-17-9-12-19(13-10-17)30-23(29)20-14-11-18(24)15-21(20)25/h9-16H,2-8H2,1H3,(H,27,28)/b26-16+
【InChIKey】
InChIKey=SBFIDQQCORJWIG-WGOQTCKBSA-N
【SMILES】
CCCCCCCCC(=O)N/N=C/c1ccc(cc1)OC(=O)c2ccc(cc2Cl)Cl
【MOL File】
4-(2-NONANOYLCARBOHY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2-NONANOYLCARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE.cml