beta-Piperidinoethyl m-butylthiobenzoate

2-piperidin-1-ylethyl 4-butylsulfanylbenzoate

CAS: 67032-54-6

Molecular Formula	`C18H27NO2S`
Molecular Weight	321.5 g/mol
LogP	4.4
Topological Polar Surface Area	54.8 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	9
Exact Mass	321.17624
Heavy Atoms	22
Complexity	310.0

Chemical Identifiers

CAS Number	67032-54-6
SMILES	`CCCCSC1=CC=C(C=C1)C(=O)OCCN2CCCCC2`
InChIKey	`ZKGKEEWMRXLJRV-UHFFFAOYSA-N`

📖 Product Overview

beta-Piperidinoethyl m-butylthiobenzoate (CAS: 67032-54-6) is a chemical compound with molecular formula C18H27NO2S and molecular weight 321.5 g/mol. Its IUPAC systematic name is 2-piperidin-1-ylethyl 4-butylsulfanylbenzoate. LogP 4.4 Topological Polar Surface Area 54.8 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 9 Exact Mass 321.17624 Heavy Atoms 22 Complexity 310.0 InChI Key: ZKGKEEWMRXLJRV-UHFFFAOYSA-N. SMILES: CCCCSC1=CC=C(C=C1)C(=O)OCCN2CCCCC2.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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