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Pentadecafluorooctanoic acid

analytical standard

Synonym(s):

PFAS, PFOA, Perfluorocaprylic acid, Perfluorooctanoic acid

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About This Item

Linear Formula:
CF3(CF2)6COOH
CAS Number:
335-67-1
Molecular Weight:
414.07
Beilstein:
1809678
EC Number:
206-397-9
MDL number:
MFCD00004174
UNSPSC Code:
85151701
PubChem Substance ID:
329754663
NACRES:
NA.24

grade

analytical standard

Quality Level

100

Agency

suitable for ASTM® 7968
suitable for ASTM® 7979
suitable for DIN 38407-42
suitable for EPA 1633
suitable for EPA 533
suitable for EPA 537.1
suitable for EPA 8327
suitable for EPA ACB B21-02
suitable for EPA ACB B23-05b
suitable for EPA OTM-45
suitable for GB 31604.35-2016
suitable for GB 5009.253-2016
suitable for ISO 21675 2019
suitable for ISO 25101

reg. compliance

suitable for FDA C-010.02

shelf life

limited shelf life, expiry date on the label

technique(s)

HPLC: suitable
gas chromatography (GC): suitable

bp

189 °C/736 mmHg (lit.)

mp

55-56 °C (lit.)

application(s)

cleaning products
cosmetics
environmental
food and beverages
personal care

format

neat

SMILES string

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

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)

InChI key

SNGREZUHAYWORS-UHFFFAOYSA-N

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General description

Pentadecafluorooctanoic acid is a perfluoroalkyl carboxylic acid, which is primarily used as an ion pair reagent.

Application

Pentadecafluorooctanoic acid may be used as an ion pair reagent in the determination of underivatized amino acids in fermentation media using liquid chromatography coupled with tandem mass spectrometry (LC-MS-MS).
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Legal Information

ASTM is a registered trademark of American Society for Testing and Materials

Signal Word

Danger

Hazard Classifications

Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Carc. 2 - Eye Dam. 1 - Lact. - Repr. 1B - Skin Corr. 1C - STOT RE 1

Target Organs

Liver

Storage Class Code

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 3

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
BCCL8180
BCCL1957
BCCK7197
BCCH7915
BCCG9588

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Ion-pair reversed-phase liquid chromatography for determination of polar underivatized amino acids using perfluorinated carboxylic acids as ion pairing agent.
Petritis NK, et al.
Journal of Chromatography A, 833(2), 147-155 (1999)
Rapid determination of underivatized pyroglutamic acid, glutamic acid, glutamine and other relevant amino acids in fermentation media by LC-MS-MS.
Qu J, et al.
Analyst, 127(1), 66-69 (2002)
Anne Vested et al.
Environmental health perspectives, 121(4), 453-458 (2013-01-31)
Perfluorinated alkyl acids (PFAAs), persistent chemicals with unique water-, dirt-, and oil-repellent properties, are suspected of having endocrine-disrupting activity. The PFAA compounds perfluorooctanoic acid (PFOA) and perfluorooctane sulfonic acid (PFOS) are found globally in humans; because they readily cross the
A K Rosenmai et al.
Toxicology and applied pharmacology, 266(1), 132-142 (2012-11-13)
Polyfluoroalkyl phosphate surfactants (PAPS) are widely used in food contact materials (FCMs) of paper and board and have recently been detected in 57% of investigated materials. Human exposure occurs as PAPS have been measured in blood; however knowledge is lacking
A Hagenaars et al.
Chemosphere, 91(6), 844-856 (2013-02-23)
The aquatic environment is an important site for perfluorooctanoic acid (PFOA) deposit. Nevertheless, the exact mode of action and its resulting toxicological effects in aquatic organisms remain largely unknown. To gain a better understanding of the mode of action of
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