(Pentafluorophenyl)acetic acid

Names

[ CAS No. ]:
653-21-4

[ Name ]:
(Pentafluorophenyl)acetic acid

[Synonym ]:
EINECS 211-497-0
2-(2,3,4,5,6-pentafluorophenyl)acetic acid
MFCD00004316
(Pentafluorophenyl)acetic acid
Benzeneacetic acid, 2,3,4,5,6-pentafluoro-

Chemical & Physical Properties

[ Density]:
1.6±0.1 g/cm3

[ Boiling Point ]:
235.3±35.0 °C at 760 mmHg

[ Melting Point ]:
108-110 °C(lit.)

[ Molecular Formula ]:
C₈H₃F₅O₂

[ Molecular Weight ]:
226.100

[ Flash Point ]:
96.1±25.9 °C

[ Exact Mass ]:
226.005325

[ PSA ]:
37.30000

[ LogP ]:
1.69

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.454

MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ HS Code ]:
2916399090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

Benzene,1,2,3,4,5-pentafluoro-6-methyl-
1-Bromo-2,3,4,5,6-pentafluorobenzene
Pentafluorobenzaldehyde
IODOPENTAFLUOROBENZENE
(Pentafluorophenyl)methanol
2,3,4,5,6-Pentafluorobenzylchloride
Pentafluorobenzyl Bromide
(Pentafluorophenyl)acetonitrile
Carbon dioxide

DownStream

Benzeneethanol,2,3,4,5,6-pentafluoro-
2-(2,3,4,5,6-pentafluorophenyl)acetamide
Benzeneacetyl chloride,2,3,4,5,6-pentafluoro-
1,2,3,4,5-pentafluoro-6-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]benzene

Customs

[ HS Code ]: 2916399090

[ Summary ]:
2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Articles

Synthesis and Biological Evaluation of Fluorinated 3-Phenylcoumarin-7-O-Sulfamate Derivatives as Steroid Sulfatase Inhibitors.

Chem. Biol. Drug Des. 87 , 233-8, (2016)

In the present work, we report the initial results of our study on a series of 3-phenylcoumarin sulfamate-based compounds containing C-F bonds as novel inhibitors of steroid sulfatase. The new compoun...

Aromatic polyfluoro-compounds. Part VIII. Pentafluorobenzaldehyde and related pentafluorophenyl ketones and carboxylic acids. Barbour AK, et al.

J. Chem. Soc. , 808-17, (1961)

Synthetic receptors as models for alkali metal cation-pi binding sites in proteins.

Proc. Natl. Acad. Sci. U. S. A. 97(12) , 6271-6, (2000)

The alkali metal cations Na(+) and K(+) have several important physiological roles, including modulating enzyme activity. Recent work has suggested that alkali metal cations may be coordinated by pi s...

Bis(pentafluorophenyl)acetic Acid
chloro-acetic acid-{4-[5-(4-nitro-phenoxy)-pentyloxy]-anilide}
(ETHYLSULFINYL)ACETIC ACID
(Benzyloxy)acetic acid
phenylthiocarbamoylsulfanyl-acetic acid ethyl ester
(+)-Acetic acid (2R)-2α-(3,4-dimethoxyphenyl)-7-methoxy-4α-hydroxychroman-3β-yl ester
1H-Pyrrolo[2,3-B]pyridine-3-ethanol, 5-chloro-2-(triethylsilyl)-
4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
N-[2-(3-methylphenyl)-4-oxo-4H-chromen-6-yl]thiophene-2-carboxamide
2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
(4-Methyl-tetrahydro-furan-2-yl)-methanol
N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
6-Chloro-3-methyl-5-nitro-1,2-benzisothiazole
4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde