2-Hydroxy-3-(3,4-dichlorophenylthio)propylamine

Base Information

• Chemical Name: 2-Hydroxy-3-(3,4-dichlorophenylthio)propylamine
• CAS No.: 50510-16-2
• Molecular Formula: C₉H₁₁Cl₂NOS
• Molecular Weight: 252.164
• Hs Code.: 2930909090
• NSC Number: 303609
• Nikkaji Number: J90.388D
• Mol file: 50510-16-2.mol

Synonyms:50510-16-2;2-Hydroxy-3-(3,4-dichlorophenylthio)propylamine;NSC 303609;BRN 2525440;1-Amino-3-((3,4-dichlorophenyl)thio)-2-propanol;NSC303609;2-Propanol, 1-amino-3-((3,4-dichlorophenyl)thio)-;Propylamine, 3-((3,4-dichlorophenyl)thio)-2-hydroxy-;2-Propanol,4-dichlorophenyl)thio]-;AKOS014854717;NSC-303609

Chemical Property of 2-Hydroxy-3-(3,4-dichlorophenylthio)propylamine

Chemical Property:

• Vapor Pressure: 1.36E-07mmHg at 25°C
• Boiling Point: 413.9°Cat760mmHg
• Flash Point: 204.1°C
• PSA: 71.55000
• Density: 1.41g/cm³
• LogP: 3.10540
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 250.9938405
• Heavy Atom Count: 14
• Complexity: 173

Purity/Quality:

99% ^*data from raw suppliers

1-AMINO-3-[(3,4-DICHLOROPHENYL)THIO]-2-PROPANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1SCC(CN)O)Cl)Cl

Technology Process of 2-Hydroxy-3-(3,4-dichlorophenylthio)propylamine

There total 1 articles about 2-Hydroxy-3-(3,4-dichlorophenylthio)propylamine 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:

(3,4-dichloro-phenylsulfanylmethyl)-oxirane (50510-21-9) → 1-amino-3-(3,4-dichloro-phenylsulfanyl)-propan-2-ol (50510-16-2)

Guidance literature:

With ammonium hydroxide;

DOI:10.1021/jm00263a022

Reference yield:

bromocyane (506-68-3) + 1-amino-3-(3,4-dichloro-phenylsulfanyl)-propan-2-ol (50510-16-2) → 5-(3,4-dichloro-phenylsulfanylmethyl)-4,5-dihydro-oxazol-2-ylamine (50510-12-8)

Guidance literature:

With sodium acetate; In methanol;

DOI:10.1021/jm00263a022

upstream raw materials:

(3,4-dichloro-phenylsulfanylmethyl)-oxirane

Downstream raw materials:

5-(3,4-dichloro-phenylsulfanylmethyl)-4,5-dihydro-oxazol-2-ylamine

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