2,3,4-Trichlorophenyl isothiocyanate

Base Information

• Chemical Name: 2,3,4-Trichlorophenyl isothiocyanate
• CAS No.: 127142-69-2
• Molecular Formula: C₇H₂Cl₃NS
• Molecular Weight: 238.525
• Hs Code.: 2930909090
• European Community (EC) Number: 671-361-5
• DSSTox Substance ID: DTXSID80155441
• Mol file: 127142-69-2.mol

Synonyms:2,3,4-Trichlorophenyl isothiocyanate;127142-69-2;1,2,3-Trichloro-4-isothiocyanatobenzene;Benzene, 1,2,3-trichloro-4-isothiocyanato-;2,3,4-Trichlorophenylisothiocyanate;Benzene,1,2,3-trichloro-4-isothiocyanato-;trichloro phenyl isothiocyanate;SCHEMBL1457070;DTXSID80155441;NUAGIDXAYVLNEG-UHFFFAOYSA-N;MFCD00041049;AKOS015850024;FS-5373;1,2,3-Trichloro-4-isothiocyanatobenzene #;CS-0147064;FT-0609374;E81892

Chemical Property of 2,3,4-Trichlorophenyl isothiocyanate

Chemical Property:

• Vapor Pressure: 0.000234mmHg at 25°C
• Melting Point: 68 °C
• Refractive Index: 1.633
• Boiling Point: 335.4 °C at 760 mmHg
• Flash Point: 156.6 °C
• PSA: 44.45000
• Density: 1.5 g/cm³
• LogP: 4.38110
• Storage Temp.: Keep Cold
• Sensitive.: Moisture Sensitive
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 236.897353
• Heavy Atom Count: 12
• Complexity: 205

Purity/Quality:

98%min ^*data from raw suppliers

2,3,4-TrichlorophenylΙsothiocyanate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• 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(=C1N=C=S)Cl)Cl)Cl