199535-00-7 | 4-(Methanesulfonylmethyl)benzoic acid

Packsize	Purity	Availability	Price	Discounted Price
250mg	98%	in stock	$169.00	$118.00
1g	98%	in stock	$386.00	$270.00
5g	98%	in stock	$1,504.00	$1,053.00

Description

• Catalog Number: AF36885
• Chemical Name: 4-(Methanesulfonylmethyl)benzoic acid
• CAS Number: 199535-00-7
• Molecular Formula: C9H10O4S
• Molecular Weight: 214.2383
• MDL Number: MFCD06384990
• SMILES: OC(=O)c1ccc(cc1)CS(=O)(=O)C

Computed Properties

• Complexity: 293
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 14
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3
• XLogP3: 1

Literature

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

  Bioorganic & medicinal chemistry letters 20101101

• Design and synthesis of benzoic acid derivatives as influenza neuraminidase inhibitors using structure-based drug design.

  Journal of medicinal chemistry 19971205