25739-23-5 | 4-(Phenylethynyl)benzoic acid

Packsize	Purity	Availability	Price	Discounted Price
100mg	97%	in stock	$10.00	$7.00
250mg	97%	in stock	$16.00	$11.00
1g	97%	in stock	$36.00	$25.00
5g	97%	in stock	$150.00	$105.00
100g	97%	in stock	$1,879.00	$1,316.00

Description

• Catalog Number: AF30124
• Chemical Name: 4-(Phenylethynyl)benzoic acid
• CAS Number: 25739-23-5
• Molecular Formula: C15H10O2
• Molecular Weight: 222.2387
• MDL Number: MFCD00438677
• SMILES: OC(=O)c1ccc(cc1)C#Cc1ccccc1

Computed Properties

• Complexity: 319
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 17
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3
• XLogP3: 3.5

Literature

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

  Bioorganic & medicinal chemistry letters 20101101

• Membrane anchoring of diacylglycerol lactones substituted with rigid hydrophobic acyl domains correlates with biological activities.

  The FEBS journal 20100101