5-[4-Fluoro-3-(trifluoromethyl)phenyl]furan-2-carbaldehyde

Base Information

• Chemical Name: 5-[4-Fluoro-3-(trifluoromethyl)phenyl]furan-2-carbaldehyde
• CAS No.: 306936-05-0
• Molecular Formula: C₁₂H₆F₄O₂
• Molecular Weight: 258.172
• Hs Code.: 2932190090
• DSSTox Substance ID: DTXSID70381858
• Wikidata: Q82172990
• ChEMBL ID: CHEMBL4453269
• Mol file: 306936-05-0.mol

Synonyms:306936-05-0;5-[4-fluoro-3-(trifluoromethyl)phenyl]furan-2-carbaldehyde;5-[4-fluoro-3-(trifluoromethyl)phenyl]-2-furaldehyde;5-(4-Fluoro-3-(trifluoromethyl)phenyl)furan-2-carbaldehyde;5-[4-Fluoro-3-(trifluoromethyl)-phenyl]-2-furaldehyde;ACETALDEHYDEAMMONIA;CHEMBL4453269;DTXSID70381858;CBNXGQUIJRGZRX-UHFFFAOYSA-N;MFCD01571138;AKOS009157942;AS-9322;SB61980;CS-0327990;FT-0619906;5-[4-fluoro-3-(trifluoromethyl)phenyl]-2-furaldehyde, AldrichCPR

Chemical Property of 5-[4-Fluoro-3-(trifluoromethyl)phenyl]furan-2-carbaldehyde

Chemical Property:

• Vapor Pressure: 0.000177mmHg at 25°C
• Melting Point: 89 °C
• Refractive Index: 1.498
• Boiling Point: 329.5°Cat760mmHg
• Flash Point: 153.1°C
• PSA: 30.21000
• Density: 1.381g/cm³
• LogP: 3.91700
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 258.03039208
• Heavy Atom Count: 18
• Complexity: 305

Purity/Quality:

97% ^*data from raw suppliers

5-[4-Fluoro-3-(trifluoromethyl)phenyl]-2-furaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 36/37/38-36-25
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1C2=CC=C(O2)C=O)C(F)(F)F)F