Compound C14H18Cl2N2O2

3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]oxolan-2-one chloride

CAS: 77694-18-9

Molecular Formula	`C14H18Cl2N2O2`
Molecular Weight	317.2 g/mol
Topological Polar Surface Area	34.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	316.07452
Heavy Atoms	20
Complexity	331.0

Chemical Identifiers

CAS Number	77694-18-9
SMILES	`C1COC(=O)C1[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl.[Cl-]`
InChIKey	`PAOGXDSJMVZBIF-UHFFFAOYSA-N`

📖 Product Overview

Compound C14H18Cl2N2O2 (CAS: 77694-18-9) is a chemical compound with molecular formula C14H18Cl2N2O2 and molecular weight 317.2 g/mol. Its IUPAC systematic name is 3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]oxolan-2-one chloride. Topological Polar Surface Area 34.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 2 Exact Mass 316.07452 Heavy Atoms 20 Complexity 331.0 InChI Key: PAOGXDSJMVZBIF-UHFFFAOYSA-N. SMILES: C1COC(=O)C1[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl.[Cl-].

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