Acetic acid, (2,4,5-trichlorophenoxy)-, 1,4-piperazinediyldi-2,1-ethanediyl ester, dihydrochloride structure

Acetic acid, (2,4,5-trichlorophenoxy)-, 1,4-piperazinediyldi-2,1-ethanediyl ester, dihydrochloride

2-[4-[2-[2-(2,4,5-trichlorophenoxy)acetyl]oxyethyl]piperazin-1-yl]ethyl 2-(2,4,5-trichlorophenoxy)acetate;dihydrochloride

CAS: 105115-40-0
Molecular Formula C24H26Cl8N2O6
Molecular Weight 722.1 g/mol
Topological Polar Surface Area 77.5 A2
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 8
Rotatable Bonds 14
Exact Mass 721.924
Heavy Atoms 40
Complexity 689.0

Chemical Identifiers

CAS Number 105115-40-0
SMILES C1CN(CCN1CCOC(=O)COC2=CC(=C(C=C2Cl)Cl)Cl)CCOC(=O)COC3=CC(=C(C=C3Cl)Cl)Cl.Cl.Cl
InChIKey UWPHOKQBIVROGS-UHFFFAOYSA-N

📖 Product Overview

Acetic acid, (2,4,5-trichlorophenoxy)-, 1,4-piperazinediyldi-2,1-ethanediyl ester, dihydrochloride (CAS: 105115-40-0) is a chemical compound with molecular formula C24H26Cl8N2O6 and molecular weight 722.1 g/mol. Its IUPAC systematic name is 2-[4-[2-[2-(2,4,5-trichlorophenoxy)acetyl]oxyethyl]piperazin-1-yl]ethyl 2-(2,4,5-trichlorophenoxy)acetate;dihydrochloride. Topological Polar Surface Area 77.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 8 Rotatable Bonds 14 Exact Mass 721.924 Heavy Atoms 40 Complexity 689.0 InChI Key: UWPHOKQBIVROGS-UHFFFAOYSA-N. SMILES: C1CN(CCN1CCOC(=O)COC2=CC(=C(C=C2Cl)Cl)Cl)CCOC(=O)COC3=CC(=C(C=C3Cl)Cl)Cl.Cl.Cl.

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