764667-68-7
2-(2-(2-(1-NAPHTHYLOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
Name2-(2-(2-(1-NAPHTHYLOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
1Identification
【Name】
2-(2-(2-(1-NAPHTHYLOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE
【CAS】
【MDL】
MFCD06200191
【English Synonyms】
【Formula】
C27 H21 Cl N2 O4
【MolWeight】
472.926
【Inchi】
InChI=1S/C27H21ClN2O4/c1-18(33-25-12-6-9-19-7-2-4-10-23(19)25)26(31)30-29-17-21-8-3-5-11-24(21)34-27(32)20-13-15-22(28)16-14-20/h2-18H,1H3,(H,30,31)/b29-17+
【InChIKey】
InChIKey=XACIDPPXNDQQRK-STBIYBPSSA-N
【SMILES】
CC(C(=O)N/N=C/c1ccccc1OC(=O)c2ccc(cc2)Cl)Oc3cccc4c3cccc4
【MOL File】
2-(2-(2-(1-NAPHTHYLO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(2-(2-(1-NAPHTHYLOXY)PROPANOYL)CARBOHYDRAZONOYL)PHENYL 4-CHLOROBENZOATE.cml