54796-53-1 | 5-Bromo-4-methylthiophene-2-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
100mg	98%	in stock	$23.00	$16.00
250mg	98%	in stock	$36.00	$25.00
1g	98%	in stock	$55.00	$38.00
5g	98%	in stock	$142.00	$99.00
10g	98%	in stock	$265.00	$186.00
25g	98%	in stock	$510.00	$357.00
100g	98%	in stock	$1,535.00	$1,074.00

Description

• Catalog Number: AB49677
• Chemical Name: 5-Bromo-4-methylthiophene-2-carboxylic acid
• CAS Number: 54796-53-1
• Molecular Formula: C6H5BrO2S
• Molecular Weight: 221.0717
• MDL Number: MFCD11110671
• SMILES: OC(=O)c1cc(c(s1)Br)C

Computed Properties

• Complexity: 151
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 2.9

Literature

• Potent new small-molecule inhibitor of botulinum neurotoxin serotype A endopeptidase developed by synthesis-based computer-aided molecular design.

  PloS one 20090101