Acetic acid, (4-chlorophenoxy)-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride

2-(azepan-1-ium-1-yl)ethyl 2-(4-chlorophenoxy)acetate chloride

CAS: 71783-90-9

Molecular Formula	`C16H23Cl2NO3`
Molecular Weight	348.3 g/mol
Topological Polar Surface Area	40.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	347.1055
Heavy Atoms	22
Complexity	298.0

Chemical Identifiers

CAS Number	71783-90-9
SMILES	`C1CCC[NH+](CC1)CCOC(=O)COC2=CC=C(C=C2)Cl.[Cl-]`
InChIKey	`HZOXOFGNIWMWQZ-UHFFFAOYSA-N`

📖 Product Overview

Acetic acid, (4-chlorophenoxy)-, 2-(hexahydro-1H-azepin-1-yl)ethyl ester, hydrochloride (CAS: 71783-90-9) is a chemical compound with molecular formula C16H23Cl2NO3 and molecular weight 348.3 g/mol. Its IUPAC systematic name is 2-(azepan-1-ium-1-yl)ethyl 2-(4-chlorophenoxy)acetate chloride. Topological Polar Surface Area 40.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 347.1055 Heavy Atoms 22 Complexity 298.0 InChI Key: HZOXOFGNIWMWQZ-UHFFFAOYSA-N. SMILES: C1CCC[NH+](CC1)CCOC(=O)COC2=CC=C(C=C2)Cl.[Cl-].

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