N-(4-Methyl-3-nitrophenyl)-N'-phenylthiourea

Base Information

• Chemical Name: N-(4-Methyl-3-nitrophenyl)-N'-phenylthiourea
• CAS No.: 347909-29-9
• Molecular Formula: C₁₄H₁₃N₃O₂S
• Molecular Weight: 287.342
• European Community (EC) Number: 668-336-6

Synonyms:Oprea1_070780;N-(4-METHYL-3-NITROPHENYL)-N'-PHENYLTHIOUREA;AKOS003713099

Chemical Property of N-(4-Methyl-3-nitrophenyl)-N'-phenylthiourea

Chemical Property:

• XLogP3: 3.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 287.07284784
• Heavy Atom Count: 20
• Complexity: 353

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)NC(=S)NC2=CC=CC=C2)[N+](=O)[O-]

Technology Process of N-(4-Methyl-3-nitrophenyl)-N'-phenylthiourea

There total 4 articles about N-(4-Methyl-3-nitrophenyl)-N'-phenylthiourea 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:

4-methyl-3-nitro-phenyl isothiocyanate (321898-79-7) → N-(4-methyl-3-nitro-phenyl)-N'-phenyl-thiourea (347909-29-9)

Guidance literature:

Multi-step reaction with 3 steps

1: water / 100 °C

2: acetic acid anhydride

With water; acetic anhydride;

Reference yield:

N,N'-bis-(4-methyl-3-nitro-phenyl)-thiourea → N-(4-methyl-3-nitro-phenyl)-N'-phenyl-thiourea (347909-29-9)

Guidance literature:

Multi-step reaction with 2 steps

1: acetic acid anhydride

With acetic anhydride;

Reference yield:

4-methyl-3-nitro-phenyl isothiocyanate (321898-79-7) + aniline (62-53-3) → N-(4-methyl-3-nitro-phenyl)-N'-phenyl-thiourea (347909-29-9)

Guidance literature:

upstream raw materials:

1,1-diphenylthiourea

4-methyl-3-nitro-phenyl isothiocyanate

aniline

Downstream raw materials:

4-acetylamino-2-nitrotoluene

4-methyl-3-nitro-phenyl isothiocyanate

Acetanilid

(4-methyl-3-nitro-phenyl)thiourea

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