98349-22-5 | 2,4,5-Trifluorobenzonitrile

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$10.00	$7.00
5g	98%	in stock	$21.00	$15.00
25g	98%	in stock	$41.00	$29.00
100g	98%	in stock	$162.00	$114.00

Description

• Catalog Number: AB59992
• Chemical Name: 2,4,5-Trifluorobenzonitrile
• CAS Number: 98349-22-5
• Molecular Formula: C7H2F3N
• Molecular Weight: 157.0927
• MDL Number: MFCD00013289
• SMILES: N#Cc1cc(F)c(cc1F)F

Computed Properties

• Complexity: 185
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 4
• XLogP3: 1.9

Literature

• Quantum chemical determination of molecular geometries and interpretation of FTIR and Raman spectra for 2,4,5- and 3,4,5-tri-fluoro-benzonitriles.

  Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20081215

• Synthesis and evaluation of 2-(2-fluoro-4-hydroxymethyl-5-methoxy-phenoxy)acetic acid as a linker in solid-phase synthesis monitored by gel-phase (19)F NMR spectroscopy.

  Organic & biomolecular chemistry 20070807

• A simple method for the preparation of pseudopure states in nuclear magnetic resonance quantum information processing.

  The Journal of chemical physics 20041101