Compound C18H28ClNO2

3-(2,4,6-trimethylpiperidin-1-ium-1-yl)propyl benzoate chloride

CAS: 67031-65-6

Molecular Formula	`C18H28ClNO2`
Molecular Weight	325.9 g/mol
Topological Polar Surface Area	30.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	6
Exact Mass	325.18085
Heavy Atoms	22
Complexity	313.0

Chemical Identifiers

CAS Number	67031-65-6
SMILES	`CC1CC([NH+](C(C1)C)CCCOC(=O)C2=CC=CC=C2)C.[Cl-]`
InChIKey	`JUJIDFQXIBBKTC-UHFFFAOYSA-N`

📖 Product Overview

Compound C18H28ClNO2 (CAS: 67031-65-6) is a chemical compound with molecular formula C18H28ClNO2 and molecular weight 325.9 g/mol. Its IUPAC systematic name is 3-(2,4,6-trimethylpiperidin-1-ium-1-yl)propyl benzoate chloride. Topological Polar Surface Area 30.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 6 Exact Mass 325.18085 Heavy Atoms 22 Complexity 313.0 InChI Key: JUJIDFQXIBBKTC-UHFFFAOYSA-N. SMILES: CC1CC([NH+](C(C1)C)CCCOC(=O)C2=CC=CC=C2)C.[Cl-].

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