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2,6-Difluorophenyl isothiocyanate

ALDRICH/511781 - 98%

CAS Number: 207974-17-2
Empirical Formula (Hill Notation): C7H3F2NS
Molecular Weight: 171.17
MDL Number: MFCD00041047
Linear Formula: F2C6H3NCS
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-511781-5G 5 g
 $67.00
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assay 98%
bp 217 °C (lit.)
density 1.325 g/mL at 25 °C (lit.)
functional group fluoro
  isothiocyanate
InChI 1S/C7H3F2NS/c8-5-2-1-3-6(9)7(5)10-4-11/h1-3H
InChI key DBSXNGIBAKYMSS-UHFFFAOYSA-N
Quality Level 100 
refractive index n20/D 1.604 (lit.)
SMILES string Fc1cccc(F)c1N=C=S
storage temp. 2-8°C
General description: 2,6-Difluorophenyl isothiocyanate (1,3-Difluoro-2-isothiocyanatobenzene), an aryl isocyanate, can be prepared from difluoroaniline. 1H-[1,2,4]triazole-3,5-diamine undergoes acylation with 2,6-difluorophenyl isothiocyanate to form the corresponding 1-acyl-1H-[1,2,4]triazole-3,5-diamine.
Packaging: 1, 5 g in glass bottle
Purity 98%
bp 217 °C (lit.)
Density 1.325 g/mL at 25 °C (lit.)
Refractive Index n20/D 1.604 (lit.)
Storage Temp. 2-8°C
UNSPSC 12352100

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