3-Thiocarbamoylpyrrolidine-1-carboxylic acid tert-butyl ester
[CAS# 122684-35-9]

Identification

• Name: 3-Thiocarbamoylpyrrolidine-1-carboxylic acid tert-butyl ester
• Molecular Formula: C₁₀H₁₈N₂O₂S
• Molecular Weight: 230.33
• CAS Registry Number: 122684-35-9
• EC Number: 889-984-8

Properties

• Solubility: Slightly soluble (1.6 g/L) (25 ºC), Calc.^*
• Density: 1.191±0.06 g/cm³ (20 ºC 760 Torr), Calc.^*
• Melting point: 131-133 ºC^**

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software V11.02 (©1994-2015 ACD/Labs)

^** MacLeod, Angus M.; Journal of Medicinal Chemistry 1990, V33(7), P2052-9.

Safety Data

Hazard Classification

Hazard	Class	Category Code	Hazard Statement
Specific target organ toxicity - single exposure	STOT SE	3	H335
Eye irritation	Eye Irrit.	2A	H319
Acute toxicity	Acute Tox.	4	H302
Skin irritation	Skin Irrit.	2	H315