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307-24-4

307-24-4 structural image
Product Name: Perfluorohexanoic acid
Formula: C6HF11O2
Synonyms: Perfluorocaproic acid;Perfluorohexanoic acid
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CHEMICAL AND PHYSICAL PROPERTIES

Color/Form Colorless liquid
Boiling Point 157 °C
Solubility In water, 15,700 mg/L at ambient temperature
Vapor Pressure 1.49 ± 0.06 [log Psd at 298.15 K (Pa)]
Stability/Shelf Life Stable under recommended storage conditions.
Enthalpy of Sublimation 68.5 ± 14.0 [ΔsubHb (kJ/mol) at 269.3-284.7 K]
Dissociation Constants pKa = -0.16
Collision Cross Section 125.1 Ų [M-H-CO2]- [CCS Type: DT; Buffer gas: N2; Dataset: PFAS]
Chemical Classes PFAS

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05
GHS Hazard Statements H314:Skin corrosion/irritation
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P363:Wash contaminated clothing before reuse.
P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405:Store locked up.

COMPUTED DESCRIPTORS

Molecular Weight 314.05 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 4
Exact Mass 313.98008905 g/mol
Monoisotopic Mass 313.98008905 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 368
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Perfluorohexanoic acid is a monocarboxylic acid that is perfluorinated hexanoic acid. It has a role as an environmental contaminant and a xenobiotic. It is functionally related to a hexanoic acid.