4-[3-(Trifluoromethyl)-3H-diazirin-3-yl]benzoic acid
[CAS# 85559-46-2]

Identification

• Name: 4-[3-(Trifluoromethyl)-3H-diazirin-3-yl]benzoic acid
• Molecular Formula: C₉H₅F₃N₂O₂
• Molecular Weight: 230.14
• CAS Registry Number: 85559-46-2
• EC Number: 686-492-3

Properties

• Solubility: Very slightly soluble (0.16 g/L) (25 ºC), Calc.^*
• Density: 1.59±0.1 g/cm³ (20 ºC 760 Torr), Calc.^*
• Melting point: 123-125 ºC (decomp)^**

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software V11.02 (©1994-2013 ACD/Labs)

^** Nassal, Michael; Liebigs Annalen der Chemie 1983, (9), P1510-23.

Safety Data

Hazard Classification

Hazard	Class	Category Code	Hazard Statement
Skin irritation	Skin Irrit.	2	H315
Specific target organ toxicity - single exposure	STOT SE	3	H335
Eye irritation	Eye Irrit.	2	H319
Acute toxicity	Acute Tox.	4	H302
Eye irritation	Eye Irrit.	2A	H319
Acute toxicity	Acute Tox.	4	H312
Acute toxicity	Acute Tox.	4	H332