SMILES string
O(CCCC)C(=O)c1c(cccc1)C(=O)OCCCC
InChI
1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3
InChI key
DOIRQSBPFJWKBE-UHFFFAOYSA-N
grade
certified reference material, TraceCERT®
product line
TraceCERT®
CofA
current certificate can be downloaded
packaging
ampule of 1 mL
concentration
5000 μg/mL in methanol
technique(s)
HPLC: suitable, gas chromatography (GC): suitable
application(s)
cleaning products
cosmetics
environmental
food and beverages
personal care
format
single component solution
storage temp.
2-8°C
General description
Di-n-butyl phthalates (DnBPs) are mainly used in personal-care products like perfumes, aftershaves, shampoos, make up and nail products, paints, etc.
This compound is listed in the SVHC (Substances of very high concern) candidate list of ECHA (European Chemicals Agency)
Application
DnBP has been used as a certified reference material (CRM) for the determination of the analyte in cleaning and personal care products by liquid chromatography-mass spectrometry (LC-MS) and as a reference standard for the identification of the analyte in tea beverages by ionic liquid-based hollow fiber liquid phase microextraction (IL-HF-PLME), coupled with high-performance liquid chromatography-diode array detection (HPLC-DAD). It may be used as a reference standard for the analysis of the analyte in food samples and as urinary metabolites in pregnant women by LC-MS.
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.
Other Notes
This Certified Reference Material (CRM) is produced and certified in accordance with ISO 17034 and ISO/IEC 17025. All information regarding the use of this CRM can be found on the certificate of analysis.
Legal Information
TraceCERT is a registered trademark of Merck KGaA, Darmstadt, Germany
signalword
Danger
Hazard Classifications
Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Flam. Liq. 2 - Repr. 1B - STOT SE 1
target_organs
Eyes,Central nervous system
存储类别
3 - Flammable liquids
wgk
WGK 2
flash_point_f
49.5 °F
flash_point_c
9.7 °C
法规信息
危险化学品
此项目有
Method development for the analysis of phthalate esters in tea beverages by ionic liquid hollow fibre liquid-phase microextraction and liquid chromatographic detection
Wang J, et al.
Food Control, 67, 278-284 (2016)
Determination of 12 urinary phthalate metabolites in Norwegian pregnant women by core-shell high performance liquid chromatography with on-line solid-phase extraction, column switching and tandem mass spectrometry
Sabaredzovic A, et al.
Journal of Chromatography. B, Biomedical Applications, 1002, 343-352 (2015)
Determination of 23 phthalic acid esters in food by liquid chromatography tandem mass spectrometry
Xu D, et al.
Journal of Chromatography A, 1324, 49-56 (2014)
Alin C Dirtu et al.
Environment international, 59, 344-353 (2013-07-31)
Human exposure to chemicals commonly encountered in our environment, like phthalates, is routinely assessed through urinary measurement of their metabolites. A particular attention is given to the specific population groups, such as obese, for which the dietary intake of environmental
Carl Simonsson et al.
Toxicology and applied pharmacology, 264(1), 114-120 (2012-07-31)
Allergic contact dermatitis (ACD) is caused by low-molecular weight compounds called haptens. It has been shown that the potency of haptens can depend on the formulation in which they are applied on the skin. Specifically the sensitization potency of isothiocyanates
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