89505
mono-Benzyl phthalate
analytical standard
Synonym(s):
1,2-Benzenedicarboxylic acid 1-(phenylmethyl) ester, Phthalic acid monobenzyl ester
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About This Item
Empirical Formula (Hill Notation):
C15H12O4
CAS Number:
Molecular Weight:
256.25
UNSPSC Code:
77101502
NACRES:
NA.24
PubChem Substance ID:
EC Number:
219-771-1
Beilstein/REAXYS Number:
1884373
MDL number:
Product Name
mono-Benzyl phthalate, analytical standard
InChI key
XIKIUQUXDNHBFR-UHFFFAOYSA-N
InChI
1S/C15H12O4/c16-14(17)12-8-4-5-9-13(12)15(18)19-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)
SMILES string
OC(C1=C(C(OCC2=CC=CC=C2)=O)C=CC=C1)=O
grade
analytical standard
assay
≥98.0% (HPLC)
shelf life
limited shelf life, expiry date on the label
technique(s)
HPLC: suitable
gas chromatography (GC): suitable
impurities
≤0.5% water
mp
103-108 °C
application(s)
cleaning products
cosmetics
environmental
food and beverages
personal care
format
neat
Quality Level
Application
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.
mono-Benzyl phthalate may be used as an analytical reference standard for the quantification of the analyte in:
- Biological samples using high-performance liquid chromatography coupled to tandem mass spectrometry (HPLC-MS/MS).
- River water samples using gas chromatography coupled to mass spectrometry (GC-MS).
General description
mono-Benzyl phthalate (MBzP) is a hydroxylated phthalate metabolite, identified as a major intermediate in the titanium dioxide (TiO2)/UV degradation of n-butyl benzyl phthalate (BBP). It is an endocrine disrupting compound and a priority pollutant found in diverse environmental samples. It finds applications as an industrial solvent and additive in a variety of products including adhesives, vinyl flooring products, car-care products, personal care products, etc. MBzP serves as an indicator or marker to determine the exposure to benzylbutyl phthalate (BBP).
Other Notes
Find a digital Reference Material for this product available on our online platform ChemisTwin® for NMR. You can use this digital equivalent on ChemisTwin® for your sample identity confirmation and compound quantification (with digital external standard). An NMR spectrum of this substance can be viewed and an online comparison against your sample can be performed with a few mouseclicks. Learn more here and start your free trial.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
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Gowoon Lee et al.
Environmental research, 189, 109874-109874 (2020-07-18)
Exposure to endocrine disrupting chemicals is suggested to be responsible for the development or progression of uterine fibroids. However, little is known about risks related to emerging chemicals, such as organophosphate esters (OPEs) and alternative plasticizers (APs). A case-control study
Jennifer Weuve et al.
Environmental health perspectives, 118(6), 825-832 (2010-02-27)
Phthalates are ubiquitous chemicals used in consumer products. Some phthalates are reproductive toxicants in experimental animals, but human data are limited. We conducted a cross-sectional study of urinary phthalate metabolite concentrations in relation to self-reported history of endometriosis and uterine
Susan M Duty et al.
Human reproduction (Oxford, England), 20(3), 604-610 (2004-12-14)
Phthalates are used in personal and consumer products, food packaging materials, and polyvinyl chloride plastics and have been measured in the majority of the general population of the USA. Consistent experimental evidence shows that some phthalates are developmental and reproductive
Correlations between phthalate metabolites in urine, serum, and seminal plasma from young Danish men determined by isotope dilution liquid chromatography tandem mass spectrometry
Frederiksen H, et al.
Journal of Analytical Toxicology, 34(7), 400-410 (2010)
Yu Zhang et al.
JAMA network open, 3(4), e202159-e202159 (2020-04-08)
Although phthalate exposure during pregnancy has been associated with preterm birth, the association of preconception exposure in either parent with preterm birth constitutes a knowledge gap. To examine the association of paternal and maternal preconception urinary concentrations of biomarkers of
Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.
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