5768-39-8 | 1,3-Benzodioxole-4-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$17.00	$12.00
5g	98%	in stock	$75.00	$53.00
10g	98%	in stock	$149.00	$105.00

Description

• Catalog Number: AB57231
• Chemical Name: 1,3-Benzodioxole-4-carboxylic acid
• CAS Number: 5768-39-8
• Molecular Formula: C8H6O4
• Molecular Weight: 166.1308
• MDL Number: MFCD01076411
• SMILES: OC(=O)c1cccc2c1OCO2
• NSC Number: 201536

Computed Properties

• Complexity: 192
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 1.3

Literature

• ATR-FTIR spectroscopy detects alterations induced by organotin(IV) carboxylates in MCF-7 cells at sub-cytotoxic/-genotoxic concentrations.

  PMC biophysics 20080101