4-Isocyanato-2-(trifluoromethyl)benzonitrile
[CAS# 143782-18-7]

Identification

• Name: 4-Isocyanato-2-(trifluoromethyl)benzonitrile
• Molecular Formula: C₉H₃F₃N₂O
• Molecular Weight: 212.13
• CAS Registry Number: 143782-18-7
• EC Number: 689-701-6
• SMILES: C1=CC(=C(C=C1N=C=O)C(F)(F)F)C#N

Properties

• Solubility: 46.06 mg/L (25 ºC water)
• Density: 1.3±0.1 g/cm³, Calc.^*
• Index of Refraction: 1.498, Calc.^*
• Melting point: 46.04 ºC
• Boiling Point: 243.38 ºC, 268.2±40.0 ºC (760 mmHg), Calc.^*
• Flash Point: 116.0±27.3 ºC, Calc.^*

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software.

Safety Data

• Hazard Symbols: GHS05;GHS06;GHS08 Danger
• Hazard Statements: H301+H331-H315-H318-H317-H334-H335
• Precautionary Statements: P501-P261-P272-P270-P271-P264-P280-P284-P302+P352-P342+P311-P362+P364-P333+P313-P301+P310+P330-P304+P340+P311-P305+P351+P338+P310-P403+P233-P405

Hazard Classification

Hazard	Class	Category Code	Hazard Statement
Skin irritation	Skin Irrit.	2	H315
Acute toxicity	Acute Tox.	4	H302
Serious eye damage	Eye Dam.	1	H318
Specific target organ toxicity - single exposure	STOT SE	3	H335