765286-87-1
1(2-(2-((1,1'-BI-PH)-4-YLOXY)PROPANOYL)CARBOHYDRAZONOYL)2-NAPHTHYL 2-CL-BENZOATE
Name1(2-(2-((1,1'-BI-PH)-4-YLOXY)PROPANOYL)CARBOHYDRAZONOYL)2-NAPHTHYL 2-CL-BENZOATE
1Identification
【Name】
1(2-(2-((1,1'-BI-PH)-4-YLOXY)PROPANOYL)CARBOHYDRAZONOYL)2-NAPHTHYL 2-CL-BENZOATE
【CAS】
【MDL】
MFCD06200087
【English Synonyms】
【Formula】
C33 H25 Cl N2 O4
【MolWeight】
549.023
【Inchi】
InChI=1S/C33H25ClN2O4/c1-22(39-26-18-15-24(16-19-26)23-9-3-2-4-10-23)32(37)36-35-21-29-27-12-6-5-11-25(27)17-20-31(29)40-33(38)28-13-7-8-14-30(28)34/h2-22H,1H3,(H,36,37)/b35-21+
【InChIKey】
InChIKey=MILRJIVPGATFQE-XICOUIIWSA-N
【SMILES】
CC(C(=O)N/N=C/c1c2ccccc2ccc1OC(=O)c3ccccc3Cl)Oc4ccc(cc4)c5ccccc5
【MOL File】
1(2-(2-((1,1'-BI-PH)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1(2-(2-((1,1'-BI-PH)-4-YLOXY)PROPANOYL)CARBOHYDRAZONOYL)2-NAPHTHYL 2-CL-BENZOATE.cml