333603

6-Phenylhexanoic acid

98%

• Synonym(s): Benzenehexanoic acid
• Linear Formula: C₆H₅(CH₂)₅CO₂H
• CAS Number: 5581-75-9
• Molecular Weight: 192.25
• MDL number: MFCD00014381
• UNSPSC Code: 12352100
• PubChem Substance ID: 24860154
• NACRES: NA.22

Properties

• Quality Level: 100
• Assay: 98%
• form: liquid
• refractive index: n20/D 1.51 (lit.)
• bp: 201-202 °C/24 mmHg (lit.)
• density: 1.022 g/mL at 25 °C (lit.)
• SMILES string: OC(=O)CCCCCc1ccccc1
• InChI: 1S/C12H16O2/c13-12(14)10-6-2-5-9-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,13,14)
• InChI key: JTXZPQIXIXYMDY-UHFFFAOYSA-N

Description

General description

6-Phenylhexanoic acid is an arylalkanoic acid.

Application

6-Phenylhexanoic acid was employed as a model compound to investigate the effects of chromophore orientation and molecular conformation on surface-enhanced Raman scattering based on metal nanostructures. It was also employed as a substrate to study the stoichiometry of side chain metabolism or complete mineralization of surrogate napthenic acids under methanogenic conditions.

Safety Information

• Pictograms: GHS07
• Signal Word: Warning
• Hazard Statements: H315,H319,H335
• Precautionary Statements: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class Code: 10 - Combustible liquids
• WGK: WGK 3
• Flash Point(F): 235.4 °F - closed cup
• Flash Point(C): 113 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves