Benzoic acid, 2,6-dimethyl-4-propoxy-, 2-(1-pyrrolidinyl)propyl ester, hydrochloride

2-pyrrolidin-1-ium-1-ylpropyl 2,6-dimethyl-4-propoxybenzoate chloride

CAS: 3737-66-4

Molecular Formula	`C19H30ClNO3`
Molecular Weight	355.9 g/mol
Topological Polar Surface Area	40.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	8
Exact Mass	355.1914
Heavy Atoms	24
Complexity	356.0

Chemical Identifiers

CAS Number	3737-66-4
SMILES	`CCCOC1=CC(=C(C(=C1)C)C(=O)OCC(C)[NH+]2CCCC2)C.[Cl-]`
InChIKey	`VRURHQHFZWVTPQ-UHFFFAOYSA-N`

📖 Product Overview

Benzoic acid, 2,6-dimethyl-4-propoxy-, 2-(1-pyrrolidinyl)propyl ester, hydrochloride (CAS: 3737-66-4) is a chemical compound with molecular formula C19H30ClNO3 and molecular weight 355.9 g/mol. Its IUPAC systematic name is 2-pyrrolidin-1-ium-1-ylpropyl 2,6-dimethyl-4-propoxybenzoate chloride. Topological Polar Surface Area 40.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 8 Exact Mass 355.1914 Heavy Atoms 24 Complexity 356.0 InChI Key: VRURHQHFZWVTPQ-UHFFFAOYSA-N. SMILES: CCCOC1=CC(=C(C(=C1)C)C(=O)OCC(C)[NH+]2CCCC2)C.[Cl-].

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