623-00-7 | 4-Bromobenzonitrile

Packsize	Purity	Availability	Price	Discounted Price
10g	98%	in stock	$8.00	$5.00
25g	98%	in stock	$11.00	$8.00
50g	98%	in stock	$14.00	$10.00
100g	98%	in stock	$20.00	$14.00
500g	98%	in stock	$98.00	$69.00

Description

• Catalog Number: AB44887
• Chemical Name: 4-Bromobenzonitrile
• CAS Number: 623-00-7
• Molecular Formula: C7H4BrN
• Molecular Weight: 182.0174
• MDL Number: MFCD00001811
• SMILES: N#Cc1ccc(cc1)Br
• NSC Number: 3978

Computed Properties

• Complexity: 127
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 9
• Hydrogen Bond Acceptor Count: 1
• XLogP3: 2.6

Literature

• 3',4'-Dimeth-oxy-biphenyl-4-carbonitrile.

  Acta crystallographica. Section E, Structure reports online 20120401

• Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

  Bioorganic & medicinal chemistry letters 20101101

• Fluorogenic derivatization of aryl halides based on the formation of biphenyl by Suzuki coupling reaction with phenylboronic acid.

  Journal of chromatography. A 20091002

• 4-Bromo-thio-benzamide.

  Acta crystallographica. Section E, Structure reports online 20090601

• Scaled quantum chemical studies on the vibrational spectra of 4-bromo benzonitrile.

  Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20090101

• 1,2-Bis[5-(4-cyano-phen-yl)-2-methyl-3-thien-yl]-3,3,4,4,5,5-hexa-fluoro-cyclo-pent-1-ene: a photochromic diaryl-ethene compound.

  Acta crystallographica. Section E, Structure reports online 20080501

• Pd-catalyzed intermolecular amidation of aryl halides: the discovery that xantphos can be trans-chelating in a palladium complex.

  Journal of the American Chemical Society 20020529