4-ISOPROPYLPHENYL ISOTHIOCYANATE

Base Information

• Chemical Name: 4-ISOPROPYLPHENYL ISOTHIOCYANATE
• CAS No.: 89007-45-4
• Molecular Formula: C10H11NS
• Molecular Weight: 177.27
• Hs Code.: 29309090
• Mol file: 89007-45-4.mol

Synonyms:1-Isopropyl-4-isothiocyanatobenzene;4-(1-Methylethyl)phenyl isothiocyanate;4-Isopropylphenyl isothiocyanate;p-Isopropylphenylisothiocyanate;

Chemical Property of 4-ISOPROPYLPHENYL ISOTHIOCYANATE

Chemical Property:

• Vapor Pressure: 0.0176mmHg at 25°C
• Refractive Index: 1.6050
• Boiling Point: 262.6 °C at 760 mmHg
• Flash Point: 113.6 °C
• PSA: 44.45000
• Density: 1 g/cm³
• LogP: 3.54430
• Sensitive.: Moisture Sensitive

Purity/Quality:

97% ^*data from raw suppliers

4-ISOPROPYLPHENYL ISOTHIOCYANATE ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4-ISOPROPYLPHENYL ISOTHIOCYANATE

There total 7 articles about 4-ISOPROPYLPHENYL ISOTHIOCYANATE 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: 90.0%

C10H13NS2*C6H15N → 4-isopropylphenyl isothiocyanate (89007-45-4)

Guidance literature:

With sodium persulfate; potassium carbonate; In water; at 20 ℃; for 1h; chemoselective reaction; Green chemistry;

DOI:10.1039/c8gc02261e

Reference yield: 74.0%

carbon disulfide (75-15-0,12122-00-8) + 4-Isopropylaniline (99-88-7) → 4-isopropylphenyl isothiocyanate (89007-45-4)

Guidance literature:

With dmap; di-tert-butyl dicarbonate; triethylamine; In ethanol; at 0 - 20 ℃; for 1h;

DOI:10.1007/s00044-019-02442-1

Reference yield: 45.0%

thiophosgene (463-71-8) + 4-Isopropylaniline (99-88-7) → 4-isopropylphenyl isothiocyanate (89007-45-4)

Guidance literature:

With triethylamine; In benzene; at 10 - 20 ℃;

DOI:10.1080/10426500802391692

upstream raw materials:

thiophosgene

4-Isopropylaniline

N,N-Dimethylthiocarbamoyl chloride

carbon disulfide

Downstream raw materials:

N-(4-Isopropylphenyl)thiourea

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