433-97-6 | 2-(Trifluoromethyl)benzoic acid

Packsize	Purity	Availability	Price	Discounted Price
25g	98%	in stock	$13.00	$10.00
100g	98%	in stock	$30.00	$21.00

Description

• Catalog Number: AB70564
• Chemical Name: 2-(Trifluoromethyl)benzoic acid
• CAS Number: 433-97-6
• Molecular Formula: C8H5F3O2
• Molecular Weight: 190.1193
• MDL Number: MFCD00002476
• SMILES: OC(=O)c1ccccc1C(F)(F)F
• NSC Number: 88326

Computed Properties

• Complexity: 200
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 1.3

Literature

• 2-(Trifluoro-meth-yl)benzoic acid.

  Acta crystallographica. Section E, Structure reports online 20110401

• Structure-activity relationships and the cytotoxic effects of novel diterpenoid alkaloid derivatives against A549 human lung carcinoma cells.

  Journal of natural medicines 20110101

• Detection of lung, breast, colorectal, and prostate cancers from exhaled breath using a single array of nanosensors.

  British journal of cancer 20100810