3-isothiocyanato Benzoyl chloride

Base Information

• Chemical Name: 3-isothiocyanato Benzoyl chloride
• CAS No.: 36915-57-8
• Molecular Formula: C8H4ClNOS
• Molecular Weight: 197.64100
• Mol file: 36915-57-8.mol

Synonyms:3-ISOTHIOCYANATO BENZOYL CHLORIDE;3-Chlorcarbonyl-phenylisothiocyanat;3-Isothiocyanato-benzoylchlorid;

Chemical Property of 3-isothiocyanato Benzoyl chloride

Chemical Property:

• Boiling Point: 321.2±25.0 °C(Predicted)
• PSA: 61.52000
• Density: 1.29±0.1 g/cm3(Predicted)
• LogP: 2.79990

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-isothiocyanato Benzoyl chloride

There total 2 articles about 3-isothiocyanato Benzoyl chloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

3-isothiocyanatobenzoic acid (2131-63-7) → 3-isothiocyanato-benzoyl chloride (36915-57-8)

Guidance literature:

With thionyl chloride;

Reference yield:

meta-aminobenzoic acid (99-05-8,159139-79-4) → 3-isothiocyanato-benzoyl chloride (36915-57-8)

Guidance literature:

Multi-step reaction with 2 steps

1: aqueous hydrochloric acid

2: thionyl chloride

With hydrogenchloride; thionyl chloride;

Reference yield:

3-isothiocyanato-benzoyl chloride (36915-57-8) → 1-isocyanato-3-isothiocyanato-benzene (77268-42-9)

Guidance literature:

With sodium azide; chlorobenzene;

upstream raw materials:

3-isothiocyanatobenzoic acid

meta-aminobenzoic acid

Downstream raw materials:

1-isocyanato-3-isothiocyanato-benzene