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442858

4-tert-Octylphenol

analytical standard

Synonym(s):

4-(1,1,3,3-Tetramethylbutyl)phenol

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About This Item

Linear Formula:
(CH3)3CCH2C(CH3)2C6H4OH
CAS Number:
140-66-9
Molecular Weight:
206.32
EC Number:
205-426-2
UNSPSC Code:
12352200
PubChem Substance ID:
24868026
Beilstein/REAXYS Number:
513992
MDL number:
MFCD00002368
NACRES:
NA.24
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grade

analytical standard

Quality Level

100

CofA

current certificate can be downloaded

packaging

ampule of 500 mg

technique(s)

HPLC: suitable, gas chromatography (GC): suitable

bp

175 °C/30 mmHg (lit.)

mp

79-82 °C (lit.)

application(s)

environmental

format

neat

storage temp.

2-30°C

SMILES string

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

InChI

1S/C14H22O/c1-13(2,3)10-14(4,5)11-6-8-12(15)9-7-11/h6-9,15H,10H2,1-5H3

InChI key

ISAVYTVYFVQUDY-UHFFFAOYSA-N

Gene Information

mouse ... Esr1(13982)

General description

This compound is listed in the SVHC (Substances of very high concern) candidate list of ECHA (European Chemicals Agency)

Application

4-tert-Octylphenol has been used as a reference standard for the determination of the analyte in water samples using ultra-high-performance liquid chromatography/tandem mass spectrometry (UHPLC/MS/MS).
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

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pictograms

CorrosionEnvironment
GHS05,GHS09

signalword

Danger

Hazard Classifications

Aquatic Acute 1 - Aquatic Chronic 1 - Eye Dam. 1 - Skin Irrit. 2

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

296.6 °F

flash_point_c

147 °C

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

140-66-9

CAS No.

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Certificates of Analysis (COA)

Lot/Batch Number
MKCV6397
MKCQ7751
MKCF7969
MKCC4688
MKBT8005

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Direct analysis of trace level bisphenol A, octylphenols and nonylphenol in bottled water and leached from bottles by ultra?high?performance liquid chromatography/tandem mass spectrometry.
Wang J and Schnute CW
Rapid Communications in Mass Spectrometry, 24(17), 2605-2610 (2010)
Qingxiang Zhou et al.
Talanta, 85(3), 1598-1602 (2011-08-03)
Present study described a simple, sensitive, and viable method for the determination of bisphenol A, 4-n-nonylphenol and 4-tert-octylphenol in water samples using temperature-controlled ionic liquid dispersive liquid-phase microextraction coupled to high performance liquid chromatography-fluorescence detector. In this experiment, 1-octyl-3-methylimidazolium hexafluorophosphate
Yanlin Wu et al.
Environmental science and pollution research international, 20(1), 3-9 (2012-07-21)
4-Tert-octylphenol (4-t-OP), a kind of endocrine-disrupting compounds, is widely distributed in natural water surroundings but can hardly be biodegraded. The advanced oxidation processes (AOPs) have been proved to be an efficient method to degrade 4-t-OP. In this study, the photodegradation
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