6099-88-3

Basic information

• Product Name: 2-CHLOROETHYL ISOTHIOCYANATE
• Synonyms: 2-CHLOROETHYL ISOTHIOCYANATE;1-Chloro-2-isothiocyanatoethane;Isothiocyanic Acid 2-Chloroethyl Ester;2-Chloroethyl isothiocyanate,98%;2-Chloroethyl isothiocyanate, 98% 5GR;Ethane, 1-chloro-2-isothiocyanato-;2-CHLOROETYL ISOTHIOCYANATE;2-chloroethyleisothiocyanate
• CAS NO: 6099-88-3
• Molecular Formula: C₃H₄ClNS
• Molecular Weight: 121.59
• Product Categories: Organic Building Blocks;Sulfur Compounds;Thiocyanates/Isothiocyanates
• Mol File: 6099-88-3.mol
• Article Data: 2

Chemical Properties

• Melting Point: 172 °C
• Boiling Point: 80 °C13 mm Hg(lit.)
• Flash Point: 110 °F
• Appearance: Clear yellow/Liquid
• Density: 1.265 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.679mmHg at 25°C
• Refractive Index: n20/D 1.556(lit.)
• Storage Temp.: Flammables area
• Sensitive: Moisture Sensitive
• BRN: 605585
• CAS DataBase Reference: 2-CHLOROETHYL ISOTHIOCYANATE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-CHLOROETHYL ISOTHIOCYANATE(6099-88-3)
• EPA Substance Registry System: 2-CHLOROETHYL ISOTHIOCYANATE(6099-88-3)

Safety Data

• Hazard Codes: Xn
• Statements: 10-20/21/22-36/37/38-42
• Safety Statements: 26-36
• RIDADR: UN 3080 6.1/PG 2
• WGK Germany: 3
• HazardClass: 8
• PackingGroup: III
• Hazardous Substances Data: 6099-88-3(Hazardous Substances Data)

Usage

Chemical Properties

clear yellow liquid

InChI:InChI=1/C3H4ClNS/c4-1-2-5-3-6/h1-2H2

Upstream product

• 75-15-0 carbon disulfide 
• 689-98-5 chloroethylamine 
• 53422-48-3 2-chloroethyl azide 
• 151-56-4 ethyleneimine 
• 463-71-8 thiophosgene 
• 870-24-6 2-chloroethanamine hydrochloride 
• 13163-21-8 aziridine-1-thiocarbonyl chloride 

Downstream Products

• 1122-82-3 isothiocyanatocyclohexane 
• 64835-70-7 2-[4-(hexafluoro-2-hydroxy-2-propyl)-N-methylanilino]-2-thiazoline 
• 942423-67-8 1-(2,3-dichlorophenyl)-2-(pyridin-4-yl)-N-(thiazolidin-2-ylidene)ethanamine 
• 68788-50-1 1,3-Selenazolidin-2-thion 
• 1779-81-3 4,5-Dihydro-thiazol-2-ylamin 
• 72647-29-1 5,6-Dihydro-3-p-tolylthiazolo<2,3-c>-s-triazole 
• 36916-67-3 (2-chloro-ethyl)-(3-phenyl-thiazolidin-2-ylidene)-amine 
• 55545-15-8 2-(2-chloro-phenylsulfanyl)-4,5-dihydro-thiazole 
• 55545-16-9 2-(2,6-dimethyl-phenylsulfanyl)-4,5-dihydro-thiazole 
• 72647-27-9 3-(4-chloro-phenyl)-5,6-dihydro-thiazolo[2,3-c][1,2,4]triazole 
• 23546-84-1 N-(2-chloro-ethyl)-carbonimidic acid dichloride 
• 1427205-72-8 (Z)-2-chloro-N-(3-(methylsulfonyl)-5-phenylthiazol-2(3H)-ylidene)ethanamine 
• 1374869-21-2 2-(3,5-diphenyl-1-pyrazolyl)-2-thiazoline 
• 1260167-99-4 8-bromo-N-(2-chloroethyl)-1-(4-(2-cyanopropan-2-yl)phenyl)-2-oxo-1H-imidazo[4,5-c]quinoline-3(2H)-carbothioamide 

Relevant articles and documents

Triton-B catalyzed one pot multicomponent synthesis of isothiocyanates in non-aqueous medium

A facile and novel method to synthesize isothiocyanides from cyclic and acyclic amines and carbon disulphide in DMSO with Triton-B as catalyst in non-aqueous medium is being reported. The method is less tedious and offers excellent yields. The structures have been elucidated by 1H NMR, 13C NMR and mass spectroscopy.