611-01-8 | 2,4-Dimethylbenzoic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$13.00	$9.00
10g	98%	in stock	$15.00	$10.00
100g	98%	in stock	$90.00	$63.00
500g	98%	in stock	$251.00	$176.00

Description

• Catalog Number: AB60300
• Chemical Name: 2,4-Dimethylbenzoic acid
• CAS Number: 611-01-8
• Molecular Formula: C9H10O2
• Molecular Weight: 150.1745
• MDL Number: MFCD00002480
• SMILES: Cc1ccc(c(c1)C)C(=O)O
• NSC Number: 407532

Computed Properties

• Complexity: 154
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 2.8

Literature

• Conformation of hydrogen-bonded dimeric o-methyl-substituted benzoic acids.

  Acta crystallographica. Section C, Crystal structure communications 20080401

• Identification by gas chromatography-mass spectrometry of the volatile organic compounds emitted from the wood-rotting fungi Serpula lacrymans and Coniophora puteana, and from Pinus sylvestris timber.

  Mycological research 20040701

• Toxicokinetics and metabolism of pseudocumene (1,2,4-trimethylbenzene) after inhalation exposure in rats.

  International journal of occupational medicine and environmental health 20020101