5381-20-4 | Benzo[b]thiophene-3-carbaldehyde

Packsize	Purity	Availability	Price	Discounted Price
250mg	97%	in stock	$7.00	$5.00
1g	97%	in stock	$10.00	$7.00
5g	>97%	in stock	$33.00	$23.00
10g	>97%	in stock	$65.00	$45.00
25g	97%	in stock	$105.00	$73.00

Description

• Catalog Number: AB43238
• Chemical Name: Benzo[b]thiophene-3-carbaldehyde
• CAS Number: 5381-20-4
• Molecular Formula: C9H6OS
• Molecular Weight: 162.2083
• MDL Number: MFCD00052376
• SMILES: O=Cc1csc2c1cccc2
• NSC Number: 18872

Computed Properties

• Complexity: 158
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• XLogP3: 2.6

Literature

• (E)-N-(1-Benzothio-phen-3-yl-methyl-idene)-2,6-dimethyl-aniline.

  Acta crystallographica. Section E, Structure reports online 20120301

• (E)-3-[(2-Methyl-4-nitro-phen-yl)imino-meth-yl]-1-benzothio-phene.

  Acta crystallographica. Section E, Structure reports online 20120201

• Identification of novel CYP2A6 inhibitors by virtual screening.

  Bioorganic & medicinal chemistry 20111201

• Microwave assisted synthesis of novel functionalized hydantoin derivatives and their conversion to 5-(Z) arylidene-4H-imidazoles.

  Molecules (Basel, Switzerland) 20110629

• Synthesis and evaluation of benzo[b]thiophene derivatives as inhibitors of alkaline phosphatases.

  Bioorganic & medicinal chemistry 20091015