769152-43-4
1-(2-((1-NAPHTHYLAMINO)(OXO)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE
Name1-(2-((1-NAPHTHYLAMINO)(OXO)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE
1Identification
【Name】
1-(2-((1-NAPHTHYLAMINO)(OXO)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE
【CAS】
【MDL】
MFCD05153545
【English Synonyms】
【Formula】
C30 H19 Cl2 N3 O4
【MolWeight】
556.403
【Inchi】
InChI=1S/C30H19Cl2N3O4/c31-20-13-14-23(25(32)16-20)30(38)39-27-15-12-19-7-1-3-9-21(19)24(27)17-33-35-29(37)28(36)34-26-11-5-8-18-6-2-4-10-22(18)26/h1-17H,(H,34,36)(H,35,37)/b33-17+
【InChIKey】
InChIKey=QWNYVJMUXAARNM-ATZGPIRCSA-N
【SMILES】
c1ccc2c(c1)cccc2NC(=O)C(=O)N/N=C/c3c4ccccc4ccc3OC(=O)c5ccc(cc5Cl)Cl
【MOL File】
1-(2-((1-NAPHTHYLAMI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-((1-NAPHTHYLAMINO)(OXO)AC)CARBOHYDRAZONOYL)-2-NAPHTHYL 2,4-DICHLOROBENZOATE.cml