n-(2,5-Dimethylphenyl)hydrazinecarbothioamide

Base Information

• Chemical Name: n-(2,5-Dimethylphenyl)hydrazinecarbothioamide
• CAS No.: 64374-53-4
• Molecular Formula: C9H13 N3 S
• Molecular Weight: 195.288
• Hs Code.: 2930909090
• DSSTox Substance ID: DTXSID70354446
• Nikkaji Number: J1.331.431D
• Wikidata: Q82132593
• Mol file: 64374-53-4.mol

Synonyms:n-(2,5-dimethylphenyl)hydrazinecarbothioamide;64374-53-4;1-amino-3-(2,5-dimethylphenyl)thiourea;3-amino-1-(2,5-dimethylphenyl)thiourea;Oprea1_500463;DTXSID70354446;AKOS000116270;4-(2,5-Dimethylphenyl)thiosemicarbazide;EN300-03634;Z56813023;N-(2,5-dimethylphenyl)hydrazinecarbothioamide, AldrichCPR

Chemical Property of n-(2,5-Dimethylphenyl)hydrazinecarbothioamide

Chemical Property:

• Vapor Pressure: 0.000698mmHg at 25°C
• Boiling Point: 308°C at 760 mmHg
• Flash Point: 140.1°C
• PSA: 89.21000
• Density: 1.228g/cm³
• LogP: 2.77520
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 195.08301860
• Heavy Atom Count: 13
• Complexity: 184

Purity/Quality:

98%Min ^*data from raw suppliers

3-Amino-1-(2,5-dimethylphenyl)thiourea ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1)C)NC(=S)NN

Technology Process of n-(2,5-Dimethylphenyl)hydrazinecarbothioamide

There total 8 articles about n-(2,5-Dimethylphenyl)hydrazinecarbothioamide 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:

C11H13N2O2S(1-)*Na(1+) → 4-(2',5'-Dimethylphenyl)-thiosemicarbazid (64374-53-4)

Guidance literature:

With hydrazine hydrate;

DOI:10.1016/j.bmcl.2019.126726

Reference yield:

C9H11NS2*H3N (108654-39-3) → 4-(2',5'-Dimethylphenyl)-thiosemicarbazid (64374-53-4)

Guidance literature:

C₉H₁₁NS₂*H₃N; With sodium monochloroacetic acid; In ethanol; at 20 ℃; for 0.5h;

With hydrazine hydrate; In ethanol; at 20 ℃; for 1h;

DOI:10.3390/molecules16064527

Reference yield:

2,5-dimethylphenyl isothiocyanate (19241-15-7) → 4-(2',5'-Dimethylphenyl)-thiosemicarbazid (64374-53-4)

Guidance literature:

With hydrazine;

upstream raw materials:

2,5-dimethylphenyl isothiocyanate

C₉H₁₀NS₂^(1-)*K⁽¹⁺⁾

C₉H₁₁NS₂*H₃N

2,5-Dimethylaniline

Downstream raw materials:

C₁₄H₁₄N₄O₃S

4-[(10S)-dihydroartemisinin-10-oxy]benzaldehyde N₄-(2,5-dimethylphenyl)thiosemicarbazone

C₁₆H₁₅BrFN₃S

10-methyl-N-(2,4-dimethylphenyl)-[1,3,4]thiadiazepino[7,6-b]quinolin-2-amine