1-Ethynyl-4-(trifluoromethoxy)benzene
[CAS# 866683-57-0]

Identification

• Name: 1-Ethynyl-4-(trifluoromethoxy)benzene
• Synonyms: (4-ethynylphenoxy)trifluoromethane; 1-ethynyl-4-(trifluoromethoxy)-benzene; 1-Ethynyl-4-(trifluoromethoxy)benzene, 4-Ethynyl-α,α,α-trifluoroanisole
• Molecular Formula: C₉H₅F₃O
• Molecular Weight: 186.13
• CAS Registry Number: 866683-57-0
• SMILES: C#CC1=CC=C(C=C1)OC(F)(F)F
• InChI: 1S/C9H5F3O/c1-2-7-3-5-8(6-4-7)13-9(10,11)12/h1,3-6H
• InChIKey: RWWGGRCLMVYXPM-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 158.1±40.0°C at 760 mmHg (Cal.)
• Flash point: 55.5±23.2°C (Cal.)
• Refractive index: 1.467 (Cal.)

Safety Data

• Safety Description: IRRITANT