(3-{[2-Chloro-5-(trifluoromethyl)phenoxy]methyl}phenyl)boronic acid
[CAS# 871126-25-9]

Identification

• Name: (3-{[2-Chloro-5-(trifluoromethyl)phenoxy]methyl}phenyl)boronic acid
• Synonyms: (3-((2-Chloro-5-(trifluoromethyl)phenoxy)methyl)phenyl)boronic acid; [3-[[2-chloro-5-(trifluoromethyl)phenoxy]methyl]phenyl]boronic acid; {3-[2-chloro-5-(trifluoromethyl)phenoxymethyl]phenyl}boronic acid
• Molecular Formula: C₁₄H₁₁BClF₃O₃
• Molecular Weight: 330.49
• CAS Registry Number: 871126-25-9
• SMILES: B(C1=CC(=CC=C1)COC2=C(C=CC(=C2)C(F)(F)F)Cl)(O)O
• InChI: 1S/C14H11BClF3O3/c16-12-5-4-10(14(17,18)19)7-13(12)22-8-9-2-1-3-11(6-9)15(20)21/h1-7,20-21H,8H2
• InChIKey: IRBNKOHBJCGIFU-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 452.0±55.0°C at 760 mmHg (Cal.)
• Flash point: 227.2±31.5°C (Cal.)
• Refractive index: 1.552 (Cal.)