769151-18-0
1-(2-((DECANOYLAMINO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE
Name1-(2-((DECANOYLAMINO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE
1Identification
【Name】
1-(2-((DECANOYLAMINO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE
【CAS】
【MDL】
MFCD05153839
【English Synonyms】
【Formula】
C30 H33 Cl2 N3 O4
【MolWeight】
570.514
【Inchi】
InChI=1S/C30H33Cl2N3O4/c1-2-3-4-5-6-7-8-13-28(36)33-20-29(37)35-34-19-25-23-12-10-9-11-21(23)14-17-27(25)39-30(38)24-16-15-22(31)18-26(24)32/h9-12,14-19H,2-8,13,20H2,1H3,(H,33,36)(H,35,37)/b34-19+
【InChIKey】
InChIKey=GTUIVCRFXNXOPH-ALQBTCKLSA-N
【SMILES】
CCCCCCCCCC(=O)NCC(=O)N/N=C/c1c2ccccc2ccc1OC(=O)c3ccc(cc3Cl)Cl
【MOL File】
1-(2-((DECANOYLAMINO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-((DECANOYLAMINO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE.cml