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

Packsize	Purity	Availability	Price	Discounted Price
250mg	97%	in stock	$29.00	$20.00
1g	97%	in stock	$34.00	$24.00
5g	97%	in stock	$143.00	$101.00
25g	97%	in stock	$689.00	$482.00
100g	97%	in stock	$1,878.00	$1,315.00

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