4-bromo-2-(trifluoromethyl)phenyl isothiocyanate

Modify Date: 2025-08-26 21:13:22

4-bromo-2-(trifluoromethyl)phenyl isothiocyanate Structure
4-bromo-2-(trifluoromethyl)phenyl isothiocyanate structure
Common Name 4-bromo-2-(trifluoromethyl)phenyl isothiocyanate
CAS Number 206559-46-8 Molecular Weight 282.080
Density 1.6±0.1 g/cm3 Boiling Point 278.4±40.0 °C at 760 mmHg
Molecular Formula C8H3BrF3NS Melting Point N/A
MSDS N/A Flash Point 122.1±27.3 °C

 Names

Name 4-bromo-2-(trifluoromethyl)phenyl isothiocyanate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.6±0.1 g/cm3
Boiling Point 278.4±40.0 °C at 760 mmHg
Molecular Formula C8H3BrF3NS
Molecular Weight 282.080
Flash Point 122.1±27.3 °C
Exact Mass 280.912170
PSA 44.45000
LogP 4.69
Vapour Pressure 0.0±0.6 mmHg at 25°C
Index of Refraction 1.548
InChIKey GWLIKBAQYRDIID-UHFFFAOYSA-N
SMILES FC(F)(F)c1cc(Br)ccc1N=C=S
Storage condition Keep Cold

 Safety Information

Hazard Codes Xi,T
Risk Phrases R20/21/22;R36/37/38
Safety Phrases S26-S36/37/39-S45
RIDADR 2810
Packaging Group III
Hazard Class 6.1
HS Code 2930909090

 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%

 Synonyms

Benzene, 4-bromo-1-isothiocyanato-2-(trifluoromethyl)-
4-Bromo-2-(trifluoromethyl)phenyl isothiocyanate
MFCD00041086
4-Bromo-1-isothiocyanato-2-(trifluoromethyl)benzene
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