3-IODOPHENYL ISOTHIOCYANATE

Base Information

• Chemical Name: 3-IODOPHENYL ISOTHIOCYANATE
• CAS No.: 3125-73-3
• Molecular Formula: C7H4INS
• Molecular Weight: 261.086
• Hs Code.: 29309090
• Mol file: 3125-73-3.mol

Synonyms:Isothiocyanicacid, m-iodophenyl ester (7CI,8CI);1-Iodo-3-isothiocyanatobenzene;3-Iodophenyl isothiocyanate;m-Iodophenyl isothiocyanate;1-iodo-3-isothiocyanatobenzene;Benzene, 1-iodo-3-isothiocyanato-;m-Iodophenylisothiocyanate;

Chemical Property of 3-IODOPHENYL ISOTHIOCYANATE

Chemical Property:

• Vapor Pressure: 0.000689mmHg at 25°C
• Melting Point: 45-48 °C(lit.)
• Refractive Index: 1.672
• Boiling Point: 318.1 °C at 760 mmHg
• Flash Point: 146.2 °C
• PSA: 44.45000
• Density: 1.76 g/cm³
• LogP: 3.02550
• Sensitive.: Moisture & Light Sensitive
• Water Solubility.: 5.483mg/L(25 oC)

Purity/Quality:

97% ^*data from raw suppliers

3-Iodophenyl Isothiocyanate >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22-36-43
• Safety Statements: 26-36/37

MSDS Files:

SDS file from LookChem

Useful:

• Uses: 3-Iodophenyl isothiocyanate may be used for the synthesis of radiopharmaceutical compounds.

Technology Process of 3-IODOPHENYL ISOTHIOCYANATE

There total 3 articles about 3-IODOPHENYL 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:

N,N-Dimethylthiocarbamoyl chloride (16420-13-6) + 3-Iodoaniline (626-01-7) → 3-iodophenyl isothiocyanate (3125-73-3)

Guidance literature:

In toluene; for 5h; Reflux;

DOI:10.1016/j.bmc.2019.06.032

Reference yield:

thiophosgene (463-71-8) + 3-Iodoaniline (626-01-7) → 3-iodophenyl isothiocyanate (3125-73-3)

Guidance literature:

With chloroform; water; at 15 ℃;

Reference yield:

→ 3-iodophenyl isothiocyanate (3125-73-3)

Guidance literature:

Aus 3-Iod-anilin, Thiophosgen;

upstream raw materials:

thiophosgene

3-Iodoaniline

N,N-Dimethylthiocarbamoyl chloride

Downstream raw materials:

1-(3-iodophenyl)thiourea

C₁₅H₁₅IN₆S₂

3-Amino-2-(3-iodo-phenylamino)-3H-quinazolin-4-one

1-tert-Butyl-3-(3-iodo-phenyl)-thiourea

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