5156-01-4 | 2-Methylterephthalic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$22.00	$16.00
5g	98%	in stock	$93.00	$66.00
10g	98%	in stock	$171.00	$120.00
25g	98%	in stock	$321.00	$225.00

Description

• Catalog Number: AG24858
• Chemical Name: 2-Methylterephthalic acid
• CAS Number: 5156-01-4
• Molecular Formula: C9H8O4
• Molecular Weight: 180.15742000000003
• MDL Number: MFCD09835103
• SMILES: OC(=O)c1ccc(c(c1)C)C(=O)O
• NSC Number: 20693

Computed Properties

• Complexity: 224
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 2
• XLogP3: 1.3

Literature

• Automated solid phase extraction and quantitative analysis of human milk for 13 phthalate metabolites.

  Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20040605