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Merck
CN

345725

2,3,6-三氟苯酚

98%

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线性分子式:
F3C6H2OH
化学文摘社编号:
分子量:
148.08
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
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产品名称

2,3,6-三氟苯酚, 98%

InChI

1S/C6H3F3O/c7-3-1-2-4(8)6(10)5(3)9/h1-2,10H

SMILES string

Oc1c(F)ccc(F)c1F

InChI key

QSFGUSFDWCVXNR-UHFFFAOYSA-N

assay

98%

form

solid

mp

33-37 °C (lit.)

functional group

fluoro

Quality Level

Application

2,3,6-Trifluorophenol may be employed as model compound to investigate the site-selective functionalization of halogen-bearing phenols by organometallic approach.

General description

2,3,6-Trifluorophenol is a fluorinated phenol. Biotransformation of 2,3,6-trifluorophenol has been studied by 19FNMR technique.

pictograms

FlameExclamation mark

signalword

Danger

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Sol. 1 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

存储类别

4.1B - Flammable solid hazardous materials

wgk

WGK 3

flash_point_f

147.2 °F - closed cup

flash_point_c

64 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves


历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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The site-selective functionalization of halogen-bearing phenols: an exercise in diversity-oriented organometallic synthesis.
Marzi E and Schlosser M.
Tetrahedron, 61(13), 3393-3401 (2005)
M G Boersma et al.
Journal of industrial microbiology & biotechnology, 26(1-2), 22-34 (2001-09-11)
Of all NMR-observable isotopes 19F is the one most convenient for studies on the biodegradation of environmental pollutants and especially for fast initial metabolic screening of newly isolated organisms. In the past decade we have identified the 19F NMR characteristics
Matthew G Romei et al.
Science (New York, N.Y.), 367(6473), 76-79 (2020-01-04)
Rotation around a specific bond after photoexcitation is central to vision and emerging opportunities in optogenetics, super-resolution microscopy, and photoactive molecular devices. Competing roles for steric and electrostatic effects that govern bond-specific photoisomerization have been widely discussed, the latter originating

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