117482-84-5 | 3-chloro-4-fluorobenzonitrile

Packsize	Purity	Availability	Price	Discounted Price
5g	97%	in stock	$7.00	$5.00
10g	97%	in stock	$9.00	$6.00
25g	97%	in stock	$17.00	$12.00
100g	97%	in stock	$50.00	$35.00

Description

• Catalog Number: AA18392
• Chemical Name: 3-chloro-4-fluorobenzonitrile
• CAS Number: 117482-84-5
• Molecular Formula: C7H3ClFN
• Molecular Weight: 155.5568
• MDL Number: MFCD00015431
• SMILES: N#Cc1ccc(c(c1)Cl)F

Computed Properties

• Complexity: 162
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 2
• XLogP3: 2.5

Literature

• Molecular structure and vibrational spectra of 3-chloro-4-fluoro benzonitrile by ab initio HF and density functional method.

  Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20081201