2-[(Diphenylmethyl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)

Base Information

• Chemical Name: 2-[(Diphenylmethyl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)
• CAS No.: 15515-58-9
• Molecular Formula: C15H17 N S . Cl H
• Molecular Weight: 279.834
• ChEMBL ID: CHEMBL1970648
• DSSTox Substance ID: DTXSID10935152
• NSC Number: 96694
• Mol file: 15515-58-9.mol

Synonyms:15515-58-9;NSC96694;NSC-96694;SCHEMBL7438013;CHEMBL1970648;DTXSID10935152;2-[(Diphenylmethyl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)

Chemical Property of 2-[(Diphenylmethyl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)

Chemical Property:

• Vapor Pressure: 1.59E-05mmHg at 25°C
• Boiling Point: 365.3°Cat760mmHg
• Flash Point: 174.7°C
• Density: 1.105g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 279.0848484
• Heavy Atom Count: 18
• Complexity: 177

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)SCCN.Cl

Technology Process of 2-[(Diphenylmethyl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1)

There total 2 articles about 2-[(Diphenylmethyl)sulfanyl]ethan-1-amine--hydrogen chloride (1/1) 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: 100.0%

1,1-Diphenylmethanol (91-01-0) + 2-mercaptoethylamine hydrochloride (156-57-0) → N-<2-(diphenylmethylthio)ethyl>amine hydrochloride (15515-58-9)

Guidance literature:

With boron trifluoride diethyl etherate; acetic acid; at 90 - 95 ℃; for 0.333333h;

DOI:10.1021/jm401754x

Reference yield: 83.0%

1,1-Diphenylmethanol (91-01-0) + 2-mercaptoethylamine hydrochloride (156-57-0) + trifluoroacetic acid (76-05-1) → N-<2-(diphenylmethylthio)ethyl>amine hydrochloride (15515-58-9) + 2-Benzhydrylsulfanyl-ethylamine; compound with trifluoro-acetic acid (116385-04-7)

Guidance literature:

Reference yield: 90.0%

N-<2-(diphenylmethylthio)ethyl>amine hydrochloride (15515-58-9) → 2-(diphenylmethylthio)ethanamine (15515-59-0)

Guidance literature:

With sodium hydrogencarbonate; In water;

DOI:10.1021/jm401754x

upstream raw materials:

1,1-Diphenylmethanol

2-mercaptoethylamine hydrochloride

trifluoroacetic acid

Downstream raw materials:

2-(benzhydrylsulfinyl)ethan-1-amine

N-<2-(diphenylmethylthiol)ethyl>-3-phenylpropylamine

N-<2-(diphenylmethylthio)ethyl>-3-phenyl-1-methylpropylamine

N-<2-(diphenylmethylthio)ethyl>-2-phenylethylamine

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