26543-97-5 | Phenol, 4-isononyl-

Packsize	Purity	Availability	Price	Discounted Price
5mg	95%	2 weeks	$356.00	$249.00
25mg	95%	2 weeks	$776.00	$543.00
50mg	95%	2 weeks	$1,336.00	$936.00
100mg	95%	2 weeks	$1,541.00	$1,079.00

Description

• Catalog Number: AB31534
• Chemical Name: Phenol, 4-isononyl-
• CAS Number: 26543-97-5
• Molecular Formula: C15H24O
• Molecular Weight: 220.3505
• MDL Number: MFCD02584964
• SMILES: CC(CCCCCCc1ccc(cc1)O)C
• NSC Number: 362474

Computed Properties

• Complexity: 157
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 1
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 7
• XLogP3: 5.6

Literature

• Discovery of novel SERCA inhibitors by virtual screening of a large compound library.

  European journal of medicinal chemistry 20110501

• Structure-based virtual screening for novel inhibitors of the sarco/endoplasmic reticulum calcium ATPase and their experimental evaluation.

  Bioorganic & medicinal chemistry 20090201

• Ozone oxidation of oestrogenic active substances in wastewater and drinking water.

  Water science and technology : a journal of the International Association on Water Pollution Research 20080101

• Identification of isomeric 4-nonylphenol structures by gas chromatography-tandem mass spectrometry combined with cluster analysis.

  Journal of chromatography. A 20060113