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:
grade
analytical standard
Quality Segment
assay
≥98.0% (HPLC)
shelf life
limited shelf life, expiry date on the label
technique(s)
HPLC: suitable, chromatography: 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
SMILES string
OC(C1=C(C(OCC2=CC=CC=C2)=O)C=CC=C1)=O
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)
InChI key
XIKIUQUXDNHBFR-UHFFFAOYSA-N
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).
Application
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).
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.
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.
Signal Word
Warning
Hazard Codes
Precautionary Statements
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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