CAS 335-67-1|pentadecafluorooctanoic acid|Pentadecafluorooctanoic acid|Perfluorocaprylic acid|perfluorooctanoic acid|Perfluorooctanoic acid 95%|Perfluorooctanoic acid 98%|Perfluorooctanoic acid 97%|...

InChI=1S/C8HF15O2/c9-2(10,1(24)25)3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)23/h(H,24,25)

SNGREZUHAYWORS-UHFFFAOYSA-N

OC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

C(C(=O)O)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Acid pKa

-4.198617

H Acceptors

H Donor

LogD (pH = 5.5)

1.5833719

LogD (pH = 7.4)

1.5833716

Log P

5.112839

Molar Refractivity

41.6619

Polarizability

16.71582

Polar Surface Area

37.3

Rotatable Bonds

Lipinski's Rule of Five

false

pentadecafluorooctanoic acid

Pentadecafluorooctanoic acidPerfluorocaprylic acidPerfluorooctanoic acid 95%Perfluorooctanoic acid 98%Perfluorooctanoic acid 97%全氟辛酸Perfluorooctanoic acidC8, perfluorooctanoatdPFOPERFLUOROOCTANOIC ACIDFC-143, F-n-octanoic acidPFOdperfluorooctanoic acidPentadecafluorooctanoic acidPFOA全氟辛酸十五氟八碳酸十五氟辛酸Perfluorooctanoic acid 99%Perfluoroheptanecarboxylic AcidEF 201A 5717Perfluoro-1-heptanecarboxylic AcidEftop EF 201n-Perfluorooctanoic Acid2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooctanoic AcidNSC 95114Pentadecafluoro-n-octanoic AcidPerfluorocaprylic acid solutionPentadecafluorooctanoic acid十五氟辛酸溶液十五氟八碳酸溶液Pentadecafluorooctanoic acid solution全氟辛酸溶液Perfluorooctanoic acid solution十五氟辛酸

IUPAC Traditional name

perfluorooctanoic acid

Click here to submit data

PC5370

Less than 80% n-isomer, balance other C-8 isomers.

PC5380

Very active fluorosurfactant with high stability

PC5375

n-isomer. Very active fluorosurfactant with high stability.

171468

Packaging
5, 25 g in glass bottle

P286500

Perfluorooctanoic acid is a perfluoroalkyl isotopomeric compound. Perfluorooctanoic acid (PFOA) is one of the most commonly used perfluorinated compounds. Being a persistent environmental pollutant, it can accumulate in human tissues via various exposure

• Aniagu, S., et al.: Toxicology, 256, 143 (2001)

• Biegel, L., et al.: Toxicol. Sci., 60, 44 (2001)

• Girault, I., et al.: Clin. Cancer Res., 9, 4415 (2001)

• Bauer, M., et al.: Cell Tissue Res., 324, 423 (2001)

Names and Identifiers

IUPAC name

pentadecafluorooctanoic acid

Synonyms

IUPAC Traditional name

perfluorooctanoic acid

Registration numbers

MDL Number

MFCD00004174

CAS Number

335-67-1

PubChem SID

2488713024850346160971566

Beilstein Number

EC Number

CHEMBL

PubChem CID

Chemspider ID

CHEBI ID

Wikipedia Title

Perfluorooctanoic_acid

Molecule Details

Apollo Scientific

PC5370

Less than 80% n-isomer, balance other C-8 isomers.

PC5380

Very active fluorosurfactant with high stability

PC5375

n-isomer. Very active fluorosurfactant with high stability.

Wikipedia

Perfluorooctanoic_acid

Sigma Aldrich

171468

Packaging
5, 25 g in glass bottle

TRC

P286500

References

PubChem Literature

From Data Sources

• Aniagu, S., et al.: Toxicology, 256, 143 (2001)

• Biegel, L., et al.: Toxicol. Sci., 60, 44 (2001)

• Girault, I., et al.: Clin. Cancer Res., 9, 4415 (2001)

• Bauer, M., et al.: Cell Tissue Res., 324, 423 (2001)

Bioactivity

PubChem BioAssay

CF3(CF2)6COOH

Grade

technical

analytical standard, for environmental analysis

Concentration

100 μg/mL in methanol

Storage Warning

IRRITANT, CORROSIVE

Corrosive/Harmful

Corrosive/Harmful/Hygroscopic/Store under Argon

RTECS

RH0781000

Risk Statements

R22 34 52/53

22-34-52/53

11-23/24/25-39/23/24/25

Main Hazard

Strong Acid, Causes Burns

Safety Statements

S26 36/37/39 45

26-36/37/39-45

7-16-36/37-45

GHS Hazard statements

H302-H314

H225-H301-H311-H331-H370

H314-H318

European Hazard Symbols

Corrosive (C)

Flammable (F)

Toxic (T)

GHS Precautionary statements

P280-P305+P351+P338-P310

P210-P260-P280-P301+P310-P311

P260-P303+P361+P353-P305+P351+P338-P301+P330+P331-P405-P501A

German water hazard class

GHS Signal Word

Danger

UN Number

3261

1230

UN3261

RID/ADR

UN 3261 8/PG 3

UN 1230 3/PG 2

Packing Group

III

GHS Pictograms

Corrosive to metals, category 1

Skin corrosion, categories 1A,1B,1C

Serious eye damage, category 1

Acute toxicity (oral, dermal, inhalation), category 4

Skin irritation, category 2

Eye irritation, category 2

Skin sensitisation, category 1

Specific Target Organ Toxicity – Single exposure, category 3

Flammable gases, category 1

Flammable aerosols, categories 1,2

Flammable liquids, categories 1,2,3

Self-reactive substances and mixtures, Types B,C,D,E,F

Pyrophoric liquids, category 1

Pyrophoric solids, category 1

Self-heating substances and mixtures

Substances and mixtures, which in contact with water, emit flammable gases, categories 1,2,3

Organic peroxides, Types B,C,D,E,F

Acute toxicity (oral, dermal, inhalation), categories 1,2,3

Respiratory sensitization, category 1

Germ cell mutagenicity, categories 1A,1B,2

Carcinogenicity, categories 1A,1B,2

Reproductive toxicity, categories 1A,1B,2

Specific Target Organ Toxicity – Single exposure, categories 1,2

Specific Target Organ Toxicity – Repeated exposure, categories 1,2

Aspiration Hazard, category 1

Personal Protective Equipment

Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges

Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

Hazard Class

Storage Temperature

2-8°C

Certificate of Analysis

Molecule

ID:8259