764655-93-8
1-(2-((TETRADECANOYLAMINO)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE
Name1-(2-((TETRADECANOYLAMINO)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE
1Identification
【Name】
1-(2-((TETRADECANOYLAMINO)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE
【CAS】
【MDL】
MFCD05154608
【English Synonyms】
【Formula】
C34 H41 Cl2 N3 O4
【MolWeight】
626.621
【Inchi】
InChI=1S/C34H41Cl2N3O4/c1-2-3-4-5-6-7-8-9-10-11-12-17-32(40)37-24-33(41)39-38-23-29-27-16-14-13-15-25(27)18-21-31(29)43-34(42)28-20-19-26(35)22-30(28)36/h13-16,18-23H,2-12,17,24H2,1H3,(H,37,40)(H,39,41)/b38-23+
【InChIKey】
InChIKey=QLTWRCBZZRJNSY-FNTLCPBMSA-N
【SMILES】
CCCCCCCCCCCCCC(=O)NCC(=O)N/N=C/c1c2ccccc2ccc1OC(=O)c3ccc(cc3Cl)Cl
【MOL File】
1-(2-((TETRADECANOYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:9.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-((TETRADECANOYLAMINO)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE.cml