2-(3,4-Dichlorophenyl)-1-hydrazinecarbothioamide

Base Information

• Chemical Name: 2-(3,4-Dichlorophenyl)-1-hydrazinecarbothioamide
• CAS No.: 13124-09-9
• Molecular Formula: C7H7 Cl2 N3 S
• Molecular Weight: 236.125
• Hs Code.: 2930909090
• European Community (EC) Number: 674-275-6
• Nikkaji Number: J307.515J
• ChEMBL ID: CHEMBL1307124
• Mol file: 13124-09-9.mol

Synonyms:13124-09-9;2-(3,4-dichlorophenyl)-1-hydrazinecarbothioamide;2-(3,4-Dichlorophenyl)hydrazinecarbothioamide;(3,4-dichloroanilino)thiourea;2-(3,4-dichlorophenyl)hydrazine-1-carbothioamide;[(3,4-dichlorophenyl)amino]thiourea;MLS000861046;SCHEMBL238488;CHEMBL1307124;KFDCINBRGZTQLH-UHFFFAOYSA-N;HMS1666L07;HMS2786I21;3,4-dichlorophenylthiosemicarbazide;MFCD00792560;AKOS005069283;CCG-253623;1-(3,4-Dichlorophenyl)thiosemicarbazide;SMR000459830;CS-0358573;A806228;10T-0017

Chemical Property of 2-(3,4-Dichlorophenyl)-1-hydrazinecarbothioamide

Chemical Property:

• Vapor Pressure: 5.83E-05mmHg at 25°C
• Melting Point: 219-220°C
• Boiling Point: 346.3°Cat760mmHg
• Flash Point: 163.2°C
• PSA: 82.17000
• Density: 1.571g/cm³
• LogP: 3.31770
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 234.9737738
• Heavy Atom Count: 13
• Complexity: 191

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1NNC(=S)N)Cl)Cl

Technology Process of 2-(3,4-Dichlorophenyl)-1-hydrazinecarbothioamide

There total 3 articles about 2-(3,4-Dichlorophenyl)-1-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: 95.0%

potassium thioacyanate (333-20-0) + 3,4-dichlorophenylhydrazine (13124-18-0) → 3,4-dichlorophenylthiosemicarbazide (13124-09-9)

Guidance literature:

With water; for 17h;

Reference yield:

3,4-dichlorophenylhydrazine hydrochloride (19763-90-7) → 3,4-dichlorophenylthiosemicarbazide (13124-09-9)

Guidance literature:

In ethanol; Heating;

Reference yield:

→ 3,4-dichlorophenylthiosemicarbazide (13124-09-9)

Guidance literature:

3,4-Dichlor-phenylhydrazin in A., 1.) wss. HCL, 2.) Kaliumthiocyanat, Δ;

DOI:10.1248/yakushi1947.87.1_43

upstream raw materials:

3,4-dichlorophenylhydrazine hydrochloride

potassium thioacyanate

3,4-dichlorophenylhydrazine

Downstream raw materials:

1-acetyl-3,4-(dichlorophenyl)thiosemicarbazide