1-(4-Hydroxyphenyl)-3-prop-2-enylthiourea

Base Information

• Chemical Name: 1-(4-Hydroxyphenyl)-3-prop-2-enylthiourea
• CAS No.: 20680-01-7
• Molecular Formula: C10H12N2OS
• Molecular Weight: 208.284
• NSC Number: 204239
• DSSTox Substance ID: DTXSID00395504
• Mol file: 20680-01-7.mol

Synonyms:20680-01-7;1-(4-HYDROXYPHENYL)-3-(PROP-2-EN-1-YL)THIOUREA;1-(4-hydroxyphenyl)-3-prop-2-enylthiourea;1-allyl-3-(4-hydroxyphenyl)thiourea;NSC204239;Oprea1_376184;SCHEMBL2236429;DTXSID00395504;AKOS002162051;NSC-204239;1-allyl-3-(4-hydroxyphenyl)-2-thiourea;SR-01000010342;SR-01000010342-1;F1097-0148

Chemical Property of 1-(4-Hydroxyphenyl)-3-prop-2-enylthiourea

Chemical Property:

• Vapor Pressure: 4.22E-05mmHg at 25°C
• Boiling Point: 340.9°Cat760mmHg
• Flash Point: 160°C
• Density: 1.256g/cm³
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 208.06703418
• Heavy Atom Count: 14
• Complexity: 200

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCNC(=S)NC1=CC=C(C=C1)O

Technology Process of 1-(4-Hydroxyphenyl)-3-prop-2-enylthiourea

There total 1 articles about 1-(4-Hydroxyphenyl)-3-prop-2-enylthiourea 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: 82.0%

4-amino-phenol (123-30-8) + N-allyl isothiocyanate (57-06-7,58391-87-0) → 1-allyl-3-(4-hydroxyphenyl)-thiourea (20680-01-7)

Guidance literature:

In acetonitrile; at 20 ℃;

Reference yield: 73.0%

1-allyl-3-(4-hydroxyphenyl)-thiourea (20680-01-7) + α-bromoacetophenone (70-11-1) → 3-allyl-2-(p-hydroxyphenylimino)-4-phenyl-3H-thiazole (328106-79-2)

Guidance literature:

With triethylamine; In ethanol; for 3h; Reflux;

DOI:10.1016/j.molstruc.2013.02.003

Reference yield: 65.0%

1-allyl-3-(4-hydroxyphenyl)-thiourea (20680-01-7) → 4-(3-allylthioureido)phenyl sulfamate (1330061-48-7)

Guidance literature:

With sulphamoyl chloride; In N,N-dimethyl acetamide; at 80 ℃; Inert atmosphere;

upstream raw materials:

4-amino-phenol

N-allyl isothiocyanate

Downstream raw materials:

4-(3-allylthioureido)phenyl sulfamate

3-allyl-2-(p-hydroxyphenylimino)-4-phenyl-3H-thiazole