767312-45-8
1-(2-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-CHLOROBENZOATE
Name1-(2-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-CHLOROBENZOATE
1Identification
【Name】
1-(2-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-CHLOROBENZOATE
【CAS】
【MDL】
MFCD05720799
【English Synonyms】
【Formula】
C26 H19 Cl N2 O3
【MolWeight】
442.9
【Inchi】
InChI=1S/C26H19ClN2O3/c1-17-6-2-4-8-21(17)25(30)29-28-16-23-22-9-5-3-7-18(22)12-15-24(23)32-26(31)19-10-13-20(27)14-11-19/h2-16H,1H3,(H,29,30)/b28-16+
【InChIKey】
InChIKey=KIXMEWRWPUHYMH-LQKURTRISA-N
【SMILES】
Cc1ccccc1C(=O)N/N=C/c2c3ccccc3ccc2OC(=O)c4ccc(cc4)Cl
【MOL File】
1-(2-(2-METHYLBENZOY….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-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-CHLOROBENZOATE.cml