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Pentafluorophenyl isothiocyanate, 96%

Catalog No. AAL1187403
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Catalog No. AAL1187403 Supplier Thermo Scientific Chemicals Supplier No. L1187403
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Description

CAS: 35923-79-6 | C7F5NS | 225.136 g/mol

Pentafluorophenyl isothiocyanate is used in the preparation of 5-isopropyl-3-pentafluorophenyl-2-thiohydantoin.

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
Pentafluorophenyl isothiocyanate is used in the preparation of 5-isopropyl-3-pentafluorophenyl-2-thiohydantoin.

Notes
Moisture sensitive. Store in a cool place. Incompatible with strong oxidizing agents, strong acids and bases.

Chemical Identifiers

CAS 35923-79-6
Molecular Formula C7F5NS
Molecular Weight (g/mol) 225.136
MDL Number MFCD00041042
InChI Key NGNKMRBGZPDABE-UHFFFAOYSA-N
Synonym pentafluorophenyl isothiocyanate, perfluorophenyl isothiocyanate, pentafluorophenylisothiocyanate, benzene, pentafluoroisothiocyanato, 2,3,4,5,6-pentafluorophenylisothiocyanate, 2,3,4,5,6-pentafluorophenyl isothiocyanate, acmc-20ajyt, pubchem5009, pentafluorophenyl isothiocyanate 1g, 2,3,4,5,6-pentafluorobenzenisothiocyanate
PubChem CID 123452
IUPAC Name 1,2,3,4,5-pentafluoro-6-isothiocyanatobenzene
SMILES C(=NC1=C(C(=C(C(=C1F)F)F)F)F)=S

Specifications

Density 1.56
Boiling Point 109°C to 110°C (35 mmHg)
Refractive Index 1.5378
Quantity 1 g
UN Number UN2922
Beilstein 2736207
Sensitivity Moisture sensitive
Formula Weight 225.14
Percent Purity 96%
Chemical Name or Material Pentafluorophenyl isothiocyanate

Safety and Handling

Hazard Category H302+H312+H332-H314-H335
Hazard Statement GHS H Statement
H331-H314-H318-H302-H312
Toxic if inhaled.
Causes severe skin burns and eye damage.
Causes serious eye damage.
Harmful if swallowed.
Harmful in contact with skin.
Precautionary Statement P260-P264b-P270-P271-P280-P303+P361+P353-P304+P340-P305+P351+P338-P310-P330-P331-P363-P501c
DOTInformation Transport Hazard Class: 8; Packing Group: III; Proper Shipping Name: CORROSIVE LIQUIDS, TOXIC, N.O.S.
EINECSNumber 252-791-9
TSCA No
Recommended Storage Keep cold; Store under Nitrogen

RUO – Research Use Only