2-(Benzylthio)ethyl nicotinate

Base Information

• Chemical Name: 2-(Benzylthio)ethyl nicotinate
• CAS No.: 101952-53-8
• Molecular Formula: C₁₅H₁₅NO₂S
• Molecular Weight: 273.356
• DSSTox Substance ID: DTXSID90144407
• Nikkaji Number: J68.289F
• Wikidata: Q83008625
• Mol file: 101952-53-8.mol

Synonyms:2-(Benzylthio)ethyl nicotinate;101952-53-8;Nicotinic acid, 2-(benzylthio)ethyl ester;BRN 0222719;DTXSID90144407;LS-96528;Nicotinic acid [2-(benzylthio)ethyl] ester

Chemical Property of 2-(Benzylthio)ethyl nicotinate

Chemical Property:

• Vapor Pressure: 4.13E-07mmHg at 25°C
• Boiling Point: 415.4°Cat760mmHg
• Flash Point: 205°C
• Density: 1.197g/cm³
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 273.08234989
• Heavy Atom Count: 19
• Complexity: 267

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CSCCOC(=O)C2=CN=CC=C2

Technology Process of 2-(Benzylthio)ethyl nicotinate

There total 1 articles about 2-(Benzylthio)ethyl nicotinate 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:

→ nicotinic acid-(2-benzylmercapto-ethyl ester) (101952-53-8)

Guidance literature:

/BRN= 143260/;