(Pentafluorophenyl)methanol

Names

[ CAS No. ]:
440-60-8

[ Name ]:
(Pentafluorophenyl)methanol

[Synonym ]:
2,3,4,5,6-Pentafluorobenzyl alcohol
Q1R BF CF DF EF FF
2,3,4,5,6-Pentafluorobenzenemethanol
2,3,4,5,6-Pentafluorobenzylic alcohol
EINECS 207-126-7
(2,3,4,5,6-Pentafluorophenyl)methanol
Benzenemethanol, 2,3,4,5,6-pentafluoro- (9CI)
Pentafluorophenylmethanol
Benzenemethanol, 2,3,4,5,6-pentafluoro-
(Pentafluorophenyl)methanol
MFCD00004602
Benzyl alcohol, 2,3,4,5,6-pentafluoro-
Pentafluorobenzyl Alcohol

Chemical & Physical Properties

[ Density]:
1.6±0.1 g/cm3

[ Boiling Point ]:
181.0±0.0 °C at 760 mmHg

[ Melting Point ]:
37-38 °C(lit.)

[ Molecular Formula ]:
C₇H₃F₅O

[ Molecular Weight ]:
198.090

[ Flash Point ]:
87.8±0.0 °C

[ Exact Mass ]:
198.010406

[ PSA ]:
20.23000

[ LogP ]:
1.22

[ Vapour Pressure ]:
0.6±0.3 mmHg at 25°C

[ Index of Refraction ]:
1.439

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DP0695000

CHEMICAL NAME :: Benzyl alcohol, 2,3,4,5,6-pentafluoro-

CAS REGISTRY NUMBER :: 440-60-8

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C7-H3-F5-O

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 900 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 54,275,1983

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302

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

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R22;R36/37/38

[ Safety Phrases ]:
S36-S36/37/39-S26-S22

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
DP0695000

[ HS Code ]:
29062900

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 2906299090

[ Summary ]:
2906299090 other aromatic alcohols。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

Articles

Atomic-resolution structures of horse liver alcohol dehydrogenase with NAD(+) and fluoroalcohols define strained Michaelis complexes.

Biochemistry 51(19) , 4035-48, (2012)

Structures of horse liver alcohol dehydrogenase complexed with NAD(+) and unreactive substrate analogues, 2,2,2-trifluoroethanol or 2,3,4,5,6-pentafluorobenzyl alcohol, were determined at 100 K at 1.1...

Structures of horse liver alcohol dehydrogenase complexed with NAD+ and substituted benzyl alcohols.

Biochemistry 33(17) , 5230-7, (1994)

Structures of the enzyme complexed with NAD+ and 2,3,4,5,6-pentafluorobenzyl alcohol were determined by X-ray crystallography at a resolution of 2.1 A and to a refinement R value of 18.3% for a monocl...

Comparison between the predicted fate of organic compounds in landfills and the actual emissions.

Environ. Sci. Technol. 35(1) , 232-9, (2001)

Emissions of organic compounds from landfills depend on the fate of the compounds inside the landfills. This field study was used to investigate the fate in landfills of organic compounds having diffe...