769146-28-3
1-(2-(PHENYLACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-CHLOROBENZOATE
Name1-(2-(PHENYLACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-CHLOROBENZOATE
1Identification
【Name】
1-(2-(PHENYLACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-CHLOROBENZOATE
【CAS】
【MDL】
MFCD05721112
【English Synonyms】
【Formula】
C26 H19 Cl N2 O3
【MolWeight】
442.9
【Inchi】
InChI=1S/C26H19ClN2O3/c27-21-13-10-20(11-14-21)26(31)32-24-15-12-19-8-4-5-9-22(19)23(24)17-28-29-25(30)16-18-6-2-1-3-7-18/h1-15,17H,16H2,(H,29,30)/b28-17+
【InChIKey】
InChIKey=SKBQNISHKAGLAQ-OGLMXYFKSA-N
【SMILES】
c1ccc(cc1)CC(=O)N/N=C/c2c3ccccc3ccc2OC(=O)c4ccc(cc4)Cl
【MOL File】
1-(2-(PHENYLACETYL)C….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-(PHENYLACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-CHLOROBENZOATE.cml