767333-89-1
3-(2-(2-(4-CHLOROPHENOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE
Name3-(2-(2-(4-CHLOROPHENOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE
1Identification
【Name】
3-(2-(2-(4-CHLOROPHENOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE
【CAS】
【MDL】
MFCD06199610
【English Synonyms】
【Formula】
C23 H17 Cl3 N2 O4
【MolWeight】
491.756
【Inchi】
InChI=1S/C23H17Cl3N2O4/c1-14(31-18-8-5-16(24)6-9-18)22(29)28-27-13-15-3-2-4-19(11-15)32-23(30)20-10-7-17(25)12-21(20)26/h2-14H,1H3,(H,28,29)/b27-13+
【InChIKey】
InChIKey=HXPMRHGLAYBBFA-UVHMKAGCSA-N
【SMILES】
CC(C(=O)N/N=C/c1cccc(c1)OC(=O)c2ccc(cc2Cl)Cl)Oc3ccc(cc3)Cl
【MOL File】
3-(2-(2-(4-CHLOROPHE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(2-(2-(4-CHLOROPHENOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATE.cml