3,5-di(trifluoromethyl)phenyl isothiocyanate

Names

[ Name ]:
3,5-di(trifluoromethyl)phenyl isothiocyanate

[Synonym ]:
3,5-di(trifluoromethyl)phenyl isothiocyanate
3,5-BIS-TRIFLUOROMETHYLPHENYL ISOTHIOCYANATE
Benzene, 1-isothiocyanato-3,5-bis(trifluoromethyl)-
3,5-Bis(trifluoromethyl)phenyl Isothiocyanate
1-isothiocyanato-3
MFCD00040838
1-isothiocyanato-3,5-bis(trifluoromethyl)benzene
Isothiocyanic Acid 3,5-Bis(trifluoromethyl)phenyl Ester

Chemical & Physical Properties

[ Density]:
1.4±0.1 g/cm3

[ Boiling Point ]:
227.5±40.0 °C at 760 mmHg

[ Melting Point ]:
160ºC

[ Molecular Formula ]:
C₉H₃F₆NS

[ Molecular Weight ]:
271.182

[ Flash Point ]:
91.4±27.3 °C

[ Exact Mass ]:
270.989044

[ PSA ]:
44.45000

[ LogP ]:
6.26

[ Vapour Pressure ]:
0.1±0.4 mmHg at 25°C

[ Index of Refraction ]:
1.459

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS06

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H301-H315-H319-H335

[ Precautionary Statements ]:
P280-P301 + P310 + P330-P304 + P340 + P312-P305 + P351 + P338-P337 + P313

[ Personal Protective Equipment ]:
Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
C,T,Xi

[ Risk Phrases ]:
R34

[ Safety Phrases ]:
S22-S26-S27-S36/37/39-S45

[ RIDADR ]:
2810

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
2930909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Preparation

Customs

[ HS Code ]: 2930909090

[ Summary ]:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Articles

Synthesis of chiral sulfoximine-based thioureas and their application in asymmetric organocatalysis.

Beilstein J. Org. Chem. 8 , 1443-51, (2012)

For the first time, chiral sulfoximine derivatives have been applied as asymmetric organocatalysts. In combination with a thiourea-type backbone the sulfonimidoyl moiety leads to organocatalysts showi...

Self-assembled monolayers of aromatic omega-aminothiols on gold: surface chemistry and reactivity.

Langmuir 26(6) , 3949-54, (2010)

Amino-terminated self-assembled monolayers on gold substrates were studied by X-ray photoelectron spectroscopy (XPS), near-edge X-ray absorption fine structure (NEXAFS) measurements, and atomic force ...

Determination of accessible amino groups on surfaces by chemical derivatization with 3,5-bis(trifluoromethyl)phenyl isothiocyanate and XPS/NEXAFS analysis.

Anal. Bioanal. Chem 396(2) , 725-38, (2010)

The determination of amino groups on surfaces capable of binding biomolecules is important for the understanding and optimization of technologically relevant coupling processes. In this study, three d...