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3-(Trifluoromethyl)phenyl isocyanate Structure

3-(Trifluoromethyl)phenyl isocyanate

  • Product Name3-(Trifluoromethyl)phenyl isocyanate
  • CAS329-01-1
  • CBNumberCB4733591
  • MFC8H4F3NO
  • MW187.12
  • EINECS206-341-3
  • MDL NumberMFCD00002020
  • MOL File329-01-1.mol

Chemical Properties

Melting point: -26 °C
Boiling point: 104 °C/83 mmHg
Density  1.34
vapor pressure  2.44 psi ( 20 °C)
refractive index  1.47
Flash point: 59 °C
storage temp.  Keep Cold
solubility  soluble in Toluene
form  clear liquid
color  Colorless to Almost colorless
Specific Gravity 1.359
Water Solubility  5.46g/L at 25℃
Sensitive  Lachrymatory
BRN  744880
Henry's Law Constant 4.8×10-3 mol/(m3Pa) at 25℃, Zhang et al. (2010)
LogP 2.04
CAS DataBase Reference 329-01-1(CAS DataBase Reference)
NIST Chemistry Reference Benzene, 1-isocyanato-3-(trifluoromethyl)-(329-01-1)
EPA Substance Registry System 3-Trifluoromethylphenyl isocyanate (329-01-1)

Safety

Symbol(GHS)  Flame (GHS02)Skull and Crossbones (GHS06)Health Hazard (GHS08)Environment (GHS09)
GHS02,GHS06,GHS08,GHS09
Signal word  Danger
Hazard statements  H330-H302-H315-H319-H334-H411-H226
Precautionary statements  P501-P273-P270-P240-P260-P210-P233-P243-P241-P242-P271-P264-P280-P284-P370+P378-P391-P342+P311-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P301+P312+P330-P304+P340+P310-P403+P233-P403+P235-P405
Hazard Codes  Xn,T,T+
Risk Statements  20/22-37/38-42-36/37/38-26-21/22-22
Safety Statements  23-28-45-36/37/39-28A-26-36/37-22-9
RIDADR  UN 2285 (ISOCYANATOBENZO- TRIFLUORIDES)
WGK Germany  2
RTECS  NR0200000
F  10
Hazard Note  Toxic/Lachrymatory/Keep Cold
TSCA  TSCA listed
HazardClass  6.1
PackingGroup  II
HS Code  2929109000
REACH Registrations Active
Limited Quantities 100ml (liquid) or 0.5 Kg (solid)
Excepted Quantities Max Inner Pack (1g or 1ml) and Max Outer Pack (500g or 500ml)
NFPA 704:
2
4 0

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3-(Trifluoromethyl)phenyl isocyanate Chemical Properties,Usage,Production

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