2,6-Dichlorobenzyl thiocyanate

Base Information

• Chemical Name: 2,6-Dichlorobenzyl thiocyanate
• CAS No.: 7534-64-7
• Molecular Formula: C8H5Cl2NS
• Molecular Weight: 218.106
• Hs Code.: 2930909090
• European Community (EC) Number: 231-401-0
• NSC Number: 118097
• UNII: 4E4RV03XX5
• DSSTox Substance ID: DTXSID10226299
• Nikkaji Number: J265.576D
• Wikidata: Q83105666
• Mol file: 7534-64-7.mol

Synonyms:2,6-Dichlorobenzyl thiocyanate;7534-64-7;1,3-dichloro-2-(thiocyanatomethyl)benzene;(2,6-dichlorophenyl)methyl thiocyanate;4E4RV03XX5;EINECS 231-401-0;NSC-118097;2,6-DICHLOROBENZYLTHIOCYANATE;NSC118097;UNII-4E4RV03XX5;DTXSID10226299;MFCD00019766;AKOS015850136;NSC 118097;CS-0455378;FT-0610606;Thiocyanic acid, (2,6-dichlorophenyl)methyl ester;{[(2,6-dichlorophenyl)methyl]sulfanyl}carbonitrile

Chemical Property of 2,6-Dichlorobenzyl thiocyanate

Chemical Property:

• Vapor Pressure: 0.000286mmHg at 25°C
• Melting Point: 39-42oC
• Refractive Index: 1.6300 (estimate)
• Boiling Point: 322.1°Cat760mmHg
• Flash Point: 148.6°C
• PSA: 49.09000
• Density: 1.42g/cm³
• LogP: 3.70768
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 216.9519757
• Heavy Atom Count: 12
• Complexity: 179

Purity/Quality:

98% ^*data from raw suppliers

2,6-DICHLOROBENZYL THIOCYANATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 37/39-26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1)Cl)CSC#N)Cl

Technology Process of 2,6-Dichlorobenzyl thiocyanate

There total 1 articles about 2,6-Dichlorobenzyl thiocyanate 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:

→ 2,6-dichlorobenzyl thiocyanate (7534-64-7)

Guidance literature:

/BRN= 472282/, NaSCN/ MeCOEt, reflux;