6-Phenylhexanoic Acid , >98.0%(GC) , 5581-75-9

Synonym(s):
Benzenehexanoic acid

CAS NO.：5581-75-9

Empirical Formula: C12H16O2

Molecular Weight: 192.25

MDL number: MFCD00014381

PRODUCT Properties

• Melting point: 17-19°C
• Boiling point: 201-202 °C24 mm Hg(lit.)
• Density: 1.022 g/mL at 25 °C(lit.)
• refractive index: n20/D 1.51(lit.)
• Flash point: >230 °F
• storage temp.: Store at room temperature
• solubility: Difficult to mix.
• pka: 4.78±0.10(Predicted)
• form: Solid
• color: White
• Water Solubility: 479.8mg/L(30 ºC)
• BRN: 1950106
• InChI: 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)
• InChIKey: JTXZPQIXIXYMDY-UHFFFAOYSA-N
• SMILES: C1(CCCCCC(O)=O)=CC=CC=C1
• CAS DataBase Reference: 5581-75-9(CAS DataBase Reference)

Description and Uses

6-Phenylhexanoic Acid (cas# 5581-75-9) is a compound useful in organic synthesis.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H315-H319-H335
• Precautionary statements: P261-P264-P271-P280-P302+P352-P305+P351+P338
• Hazard Codes: Xi
• Risk Statements: 36/37/38
• Safety Statements: 26-37/39
• WGK Germany: 3
• Hazard Note: Irritant
• HS Code: 29163900