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196746

2,3,4,5,6-Pentafluorobenzyl alcohol

Name: 2,3,4,5,6-Pentafluorobenzyl alcohol
Brand: ALDRICH

98%

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About This Item

Linear Formula:

C₆F₅CH₂OH

CAS Number:

440-60-8

Molecular Weight:

198.09

NACRES:

NA.22

PubChem Substance ID:

24851790

UNSPSC Code:

12352100

EC Number:

207-126-7

MDL number:

MFCD00004602

Assay:

98%

Form:

solid

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Properties

Quality Level

200

assay

98%

form

solid

bp

114-115 °C/60 mmHg (lit.)

mp

37-38 °C (lit.)

SMILES string

OCc1c(F)c(F)c(F)c(F)c1F

InChI

1S/C7H3F5O/c8-3-2(1-13)4(9)6(11)7(12)5(3)10/h13H,1H2

InChI key

PGJYYCIOYBZTPU-UHFFFAOYSA-N

Description

General description

Structures of complex of horse liver alchohol dehydrogenase enzyme with 2,3,4,5,6-pentafluorobenzyl alcohol has been investigated by X-ray crystallography.

Application

2,3,4,5,6-Pentafluorobenzyl alcohol was used in the synthesis of pentafluorobenzyloxy substituted metal-free phthalocyanine.

pictograms

GHS07

signalword

Warning

hcodes

H302

pcodes

P264 - P270 - P301 + P312 - P501

Hazard Classifications

Acute Tox. 4 Oral

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

190.4 °F - closed cup

flash_point_c

88 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves

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

C Oman

Environmental science & technology, 35(1), 232-239 (2001-05-16)

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 different physical, chemical, and biological characteristics. For this purpose

Mobility of fluorobenzyl alcohols bound to liver alcohol dehydrogenases as determined by NMR and X-ray crystallographic studies.

Jon K Rubach et al.

Biochemistry, 41(52), 15770-15779 (2002-12-27)

The relationship between substrate mobility and catalysis was studied with wild-type and Phe93Ala (F93A) horse liver alcohol dehydrogenase (ADH). Wild-type ADH binds 2,3,4,5,6-pentafluorobenzyl alcohol in one position as shown by X-ray results, and (19)F NMR shows five resonances for the

A gas chromatograph/resonant electron capture-TOF mass spectrometer for four dimensions of negative ion analytical information.

V G Voinov et al.

Analytical chemistry, 76(10), 2951-2957 (2004-05-18)

A prototype gas chromatograph (GC) electron monochromator (EM) reflectron time-of-flight (TOF) mass spectrometer has been constructed and demonstrated to simultaneously record four-dimensional resonant electron capture (REC) mass spectra (m/z, ion-intensity, electron-energy, and retention time) of electron-capturing compounds in real time.

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Global Trade Item Number

SKU	GTIN
196746-5G	04061832879949