6624-49-3 | Isoquinoline-3-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
250mg	97%	in stock	$22.00	$15.00
1g	97%	in stock	$26.00	$18.00
5g	97%	in stock	$47.00	$33.00
10g	97%	in stock	$61.00	$43.00
25g	97%	in stock	$144.00	$101.00

Description

• Catalog Number: AH13632
• Chemical Name: Isoquinoline-3-carboxylic acid
• CAS Number: 6624-49-3
• Molecular Formula: C10H7NO2
• Molecular Weight: 173.1681
• MDL Number: MFCD00167216
• SMILES: OC(=O)c1ncc2c(c1)cccc2
• NSC Number: 53385

Computed Properties

• Complexity: 205
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 2

Literature

• A class of novel N-isoquinoline-3-carbonyl-L-amino acid benzylesters: synthesis, anti-tumor evaluation and 3D QSAR analysis.

  European journal of medicinal chemistry 20110501

• Unusual mass spectrometric dissociation pathway of protonated isoquinoline-3-carboxamides due to multiple reversible water adduct formation in the gas phase.

  Journal of the American Society for Mass Spectrometry 20091101

• Microsphere-based protease assays and screening application for lethal factor and factor Xa.

  Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

• Cobalt(II), nickel(II) and copper(II) complexes of isoquinoline-3-carboxylate.

  Acta crystallographica. Section C, Crystal structure communications 20040701