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Merck
CN

506761

4-tert-Butylphenol

PESTANAL®, analytical standard

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About This Item

Linear Formula:
(CH3)3CC6H4OH
CAS Number:
98-54-4
Molecular Weight:
150.22
EC Number:
202-679-0
UNSPSC Code:
12352200
PubChem Substance ID:
24873390
Beilstein/REAXYS Number:
1817334
MDL number:
MFCD00002367

Key Documents

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InChI key

QHPQWRBYOIRBIT-UHFFFAOYSA-N

InChI

1S/C10H14O/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7,11H,1-3H3

SMILES string

CC(C)(C)c1ccc(O)cc1

grade

analytical standard

vapor pressure

1 mmHg ( 70 °C)

product line

PESTANAL®

CofA

current certificate can be downloaded

packaging

ampule of 1000 mg

technique(s)

HPLC: suitable, gas chromatography (GC): suitable

bp

236-238 °C (lit.)

Gene Information

mouse ... Esr1(13982)
rat ... Ar(24208)

density

0.908 g/mL at 25 °C (lit.)

application(s)

agriculture
cleaning products
cosmetics
environmental
flavors and fragrances
food and beverages
personal care

format

neat

storage temp.

2-30°C

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General description

This compound is listed in the SVHC (Substances of very high concern) candidate list of ECHA (European Chemicals Agency)
This substance is listed on the positive list of the EU regulation 10/2011 for plastics intended to come into contact with food. Find all available reference materials for compounds listed in 10/2011 here

Application

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Legal Information

PESTANAL is a registered trademark of Merck KGaA, Darmstadt, Germany

signalword

Danger

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves

Hazard Classifications

Aquatic Chronic 1 - ED ENV 1 - Eye Dam. 1 - Repr. 2 - Skin Irrit. 2

Regulatory Information

危险化学品
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Certificates of Analysis (COA)

Lot/Batch Number
LRAC8404
LRAD5374
LC25927V
LC23324V
LC19174V

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Pierre Etienne Chabrier et al.
CNS drug reviews, 13(3), 317-332 (2007-09-27)
BN82451 belongs to a new family of small molecules designated as multitargeting or hybrid molecules. BN82451 is orally active, has good central nervous system penetration, and elicits potent neuronal protection and antiinflammatory properties. Neuronal protection is due to Na+ channel
J Pablo Lamas et al.
Analytical and bioanalytical chemistry, 394(8), 2231-2239 (2009-07-07)
A method for the determination of dimethyl fumarate (DMF), benzothiazole (BT) and tert-butylphenol (TBP) in desiccant and antimould agents employed for protecting consumer products from humidity and mould has been developed. The method is based on ultrasound-assisted extraction (UAE) followed
Sonnich Meier et al.
Comparative biochemistry and physiology. Toxicology & pharmacology : CBP, 145(3), 420-430 (2007-03-09)
Offshore oil production releases large amounts of lipophilic compounds in produced water into the ocean. In 2004, 143 million m(3) produced water, containing approximately 13 tons of long-chain (>C(4)) alkylphenols (AP), was discharged from installations in the Norwegian sector of
Lei Lei et al.
Ecotoxicology (London, England), 19(7), 1268-1276 (2010-06-17)
Landfill leachates contain a large amount of unknown harmful compounds derived from domestic and industrial sources. A toxicity effect-directed approach was used to identify biologically active compounds in three landfill leachate samples (S1-S3) by combining the Microtox test with reverse-phase
Zhigang Xu et al.
Journal of chromatography. A, 1358, 52-59 (2014-07-20)
In this study, a novel dual-template molecularly imprinted polymer (MIP)-coated stir bar was prepared and coupled with high-performance liquid chromatography (HPLC) for the analysis of environmental estrogens in complex samples. Dual-template MIP coating was homogeneous and porous with an average
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