Dimethylthiocarbamoyl chloride

• CAS: 16420-13-6
• Catalog Number: ACM16420136
• Category: Other Products
• Molecular Weight: 123.6
• Molecular Formula: C₃H₆ClNS
• Synonyms: Carbamoyl chloride, dimethylthio-;Dimethylcarbamothioic chloride;dimethyl-carbamothioicchlorid;Dimethylthiocarbamyl chloride;N,N-Dimethylthiocarbamyl chloride;N,N-DIMETHYLTHIOCARBAMOYL CHLORIDE;N,N-DIMETHYLCARBAMOTHIOIC CHLORIDE;DIMETHYLTHIOCARBAMOYL CHLORIDE
• IUPAC Name: N,N-dimethylcarbamothioyl chloride
• Canonical SMILES: CN(C)C(=S)Cl
• InChI Key: PHWISQNXPLXQRU-UHFFFAOYSA-N
• Boiling Point: 90-95°C0.5mm Hg(lit.)
• Melting Point: 39-43°C(lit.)
• Flash Point: 209°F
• Density: 1.215 g/cm³
• Appearance: yellow to yellow-brown crystalline
• EC Number: 240-468-5
• Exact Mass: 122.99100
• Hazard Statements: C
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Packing Group: III
• Safety Description: 26-36/37/39-45-8-30-22-27
• Supplemental Hazard Statements: H290-H302-H314-H317-H318
• Symbol: GHS05,GHS07
• WGK Germany: 2

Synthetic Use

Downstream Synthesis Route 1

• 6968-72-5
• 16420-13-6

• 100-55-0

Reference: [1] Journal of Heterocyclic Chemistry, 2007, vol. 44, # 2, p. 487 - 489

Downstream Synthesis Route 2

• 3783-38-8
• 16420-13-6

• 2459-09-8

Reference: [1] Journal of Heterocyclic Chemistry, 2007, vol. 44, # 2, p. 487 - 489

Downstream Synthesis Route 3

• 95-54-5
• 16420-13-6

• 2851-13-0

Reference: [1] Patent: CN107954939, 2018, A, . Location in patent: Paragraph 0025

Downstream Synthesis Route 4

• 605-32-3
• 16420-13-6

• 2951-23-7

Reference: [1]Chemische Berichte,1965,vol. 98,p. 1293 - 1307

Downstream Synthesis Route 5

• 29799-07-3
• 16420-13-6

• 72032-02-1

Reference: [1]Journal of the Chemical Society. Perkin transactions II,1979,p. 1011 - 1019

Downstream Synthesis Route 6

• 824-39-5
• 16420-13-6

• 833-20-5

Reference: [1]Justus Liebigs Annalen der Chemie,1965,vol. 681,p. 64 - 84
[2]Journal of Organic Chemistry,1966,vol. 31,p. 3980 - 3984

* For details of the synthesis route, please refer to the original source to ensure accuracy.