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Merck
CN

425370

Phenol-2,3,4,5,6-d5

98 atom % D

Synonym(s):

Pentadeuteriophenol

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About This Item

Linear Formula:
C6D5OH
CAS Number:
4165-62-2
Molecular Weight:
99.14
NACRES:
NA.12
PubChem Substance ID:
24866630
UNSPSC Code:
12352001
MDL number:
MFCD00084164

Key Documents

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Product Name

Phenol-2,3,4,5,6-d5, 98 atom % D

InChI

1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H/i1D,2D,3D,4D,5D

SMILES string

[2H]c1c([2H])c([2H])c(O)c([2H])c1[2H]

InChI key

ISWSIDIOOBJBQZ-RALIUCGRSA-N

isotopic purity

98 atom % D

form

crystals

bp

182 °C (lit.)

mp

40-42 °C (lit.)

density

1.127 g/mL at 25 °C

mass shift

M+5

Quality Level

200

Related Categories

Application

Phenol-2,3,4,5,6-d5 can be used as an internal analytical standard for accurate data interpretation using various analytical techniques.

General description

Phenol-2,3,4,5,6-d5 is an isotope-labeled analog of phenol, wherein 2,3,4, 5, and 6th protons of phenol are replaced by deuterium.

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

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Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Aquatic Chronic 2 - Eye Dam. 1 - Muta. 2 - Skin Corr. 1B - STOT RE 2

target_organs

Nervous system,Kidney,Liver,Skin

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk

WGK 2

flash_point_f

174.2 °F - closed cup

flash_point_c

79 °C - closed cup

Regulatory Information

美国出口管控产品
危险化学品
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Certificates of Analysis (COA)

Lot/Batch Number
MBBC5662
MBBC4769
MBBC0235V
MBBB7442V
CC0167

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The Nature of meso-and pyro-Borate Precatalysts to the VANOL and VAPOL BOROX Catalysts
Zhao W, et al.
Synlett, 26, 1606-1614 (2015)
Development of molecularly imprinted polymer in porous film format for binding of phenol and alkylphenols from water
Gryshchenko AO and Bottaro CS
International Journal of Molecular Sciences, 15, 1338-1357 (2014)

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