200,000+ products from a single source!
sales@angenechem.com
94-18-8 | Benzyl 4-hydroxybenzoate
CAS No: 94-18-8 Catalog No: AG003O3R MDL No:MFCD00016471
Product Description
Catalog Number:
AG003O3R
Chemical Name:
Benzyl 4-hydroxybenzoate
CAS Number:
94-18-8
Molecular Formula:
C14H12O3
Molecular Weight:
228.2433
MDL Number:
MFCD00016471
IUPAC Name:
benzyl 4-hydroxybenzoate
InChI:
InChI=1S/C14H12O3/c15-13-8-6-12(7-9-13)14(16)17-10-11-4-2-1-3-5-11/h1-9,15H,10H2
InChI Key:
MOZDKDIOPSPTBH-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)C(=O)OCc1ccccc1
EC Number:
202-311-9
UNII:
8Y41DYV4VG
NSC Number:
8080
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.079g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.247g/mol
Monoisotopic Mass:
228.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| Agonistic effects of diverse xenobiotics on the constitutive androstane receptor as detected in a recombinant yeast-cell assay. | Toxicology in vitro : an international journal published in association with BIBRA 20180201 |
| Methylparaben and butylparaben alter multipotent mesenchymal stem cell fates towards adipocyte lineage. | Toxicology and applied pharmacology 20170815 |
| Parabens inhibit fatty acid amide hydrolase: A potential role in paraben-enhanced 3T3-L1 adipocyte differentiation. | Toxicology letters 20161116 |
| Human sex hormone-binding globulin binding affinities of 125 structurally diverse chemicals and comparison with their binding to androgen receptor, estrogen receptor, and α-fetoprotein. | Toxicological sciences : an official journal of the Society of Toxicology 20150201 |
| Comparative study on transcriptional activity of 17 parabens mediated by estrogen receptor α and β and androgen receptor. | Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20130701 |
| Inverse antagonist activities of parabens on human oestrogen-related receptor γ (ERRγ): in vitro and in silico studies. | Toxicology and applied pharmacology 20130701 |
| The estrogenic effects of benzylparaben at low doses based on uterotrophic assay in immature SD rats. | Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20130301 |
| Effects of parabens on adipocyte differentiation. | Toxicological sciences : an official journal of the Society of Toxicology 20130101 |
| Rat α-Fetoprotein binding affinities of a large set of structurally diverse chemicals elucidated the relationships between structures and binding affinities. | Chemical research in toxicology 20121119 |
| p-Hydroxybenzoate esters metabolism in MCF7 breast cancer cells. | Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20121101 |
| Direct rapid analysis of multiple PPCPs in municipal wastewater using ultrahigh performance liquid chromatography-tandem mass spectrometry without SPE pre-concentration. | Analytica chimica acta 20120813 |
| Aquatic toxicity and ecological risk assessment of seven parabens: Individual and additive approach. | The Science of the total environment 20111201 |
| Determination of parabens in shampoo using high performance liquid chromatography with amperometric detection on a boron-doped diamond electrode. | Talanta 20110715 |
| Determination of parabens in cosmetic products by solid-phase microextraction of poly(ethylene glycol) diacrylate thin film on fibers and ultra high-speed liquid chromatography with diode array detector. | Journal of separation science 20110701 |
| Stir bar sorptive extraction of parabens, triclosan and methyl triclosan from soil, sediment and sludge with in situ derivatization and determination by gas chromatography-mass spectrometry. | Journal of chromatography. A 20110624 |
| Many putative endocrine disruptors inhibit prostaglandin synthesis. | Environmental health perspectives 20110401 |
| Urinary concentrations of parabens and serum hormone levels, semen quality parameters, and sperm DNA damage. | Environmental health perspectives 20110201 |
| Parabens in urine, serum and seminal plasma from healthy Danish men determined by liquid chromatography-tandem mass spectrometry (LC-MS/MS). | Journal of exposure science & environmental epidemiology 20110101 |
| GC-MS determination of parabens, triclosan and methyl triclosan in water by in situ derivatisation and stir-bar sorptive extraction. | Analytical and bioanalytical chemistry 20110101 |
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Simultaneous quantitation of parabens, triclosan, and methyl triclosan in indoor house dust using solid phase extraction and gas chromatography-mass spectrometry. | Journal of environmental monitoring : JEM 20101006 |
| In-sample acetylation-non-porous membrane-assisted liquid-liquid extraction for the determination of parabens and triclosan in water samples. | Analytical and bioanalytical chemistry 20100701 |
| Occurrence and sources of selected phenolic endocrine disruptors in Ria de Aveiro, Portugal. | Environmental science and pollution research international 20100501 |
| Urinary concentrations of four parabens in the U.S. population: NHANES 2005-2006. | Environmental health perspectives 20100501 |
| Molecularly imprinted polymer for the extraction of parabens from environmental solid samples prior to their determination by high performance liquid chromatography-ultraviolet detection. | Talanta 20100315 |
| Self-reported chemicals exposure, beliefs about disease causation, and risk of breast cancer in the Cape Cod Breast Cancer and Environment Study: a case-control study. | Environmental health : a global access science source 20100101 |
| Metabolism of parabens (4-hydroxybenzoic acid esters) by hepatic esterases and UDP-glucuronosyltransferases in man. | Drug metabolism and pharmacokinetics 20100101 |
| Removal of parabens from aqueous solution using β-cyclodextrin cross-linked polymer. | International journal of molecular sciences 20100101 |
| Probabilistic ecological hazard assessment of parabens using Daphnia magna and Pimephales promelas. | Environmental toxicology and chemistry 20091201 |
| Ultra-high-performance liquid chromatography-tandem mass spectrometry for determining the presence of eleven personal care products in surface and wastewaters. | Journal of chromatography. A 20091016 |
| Evaluation of estrogenic activity of parabens and their chlorinated derivatives by using the yeast two-hybrid assay and the enzyme-linked immunosorbent assay. | Environmental toxicology and chemistry 20090101 |
| Parabens in male infertility-is there a mitochondrial connection? | Reproductive toxicology (Elmsford, N.Y.) 20090101 |
| Final amended report on the safety assessment of Methylparaben, Ethylparaben, Propylparaben, Isopropylparaben, Butylparaben, Isobutylparaben, and Benzylparaben as used in cosmetic products. | International journal of toxicology 20080101 |
| Hydrolysis of a series of parabens by skin microsomes and cytosol from human and minipigs and in whole skin in short-term culture. | Toxicology and applied pharmacology 20071201 |
| Inter-individual variability in esterases in human liver. | Biochemical pharmacology 20070915 |
| Preliminary ecological risk assessment of butylparaben and benzylparaben -1. Removal efficiency in wastewater treatment, acute/chronic toxicity for aquatic organisms, and effects on medaka gene expression. | Environmental sciences : an international journal of environmental physiology and toxicology 20070101 |
| Preliminary ecological risk assessment of butylparaben and benzylparaben -2. Fate and partitioning in aquatic environments. | Environmental sciences : an international journal of environmental physiology and toxicology 20070101 |
| Parabens as urinary biomarkers of exposure in humans. | Environmental health perspectives 20061201 |
| Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods. | Journal of molecular graphics & modelling 20061101 |
| Optimisation of a solid-phase microextraction method for the determination of parabens in water samples at the low ng per litre level. | Journal of chromatography. A 20060818 |
| Determination of parabens in pharmaceutical formulations by solid-phase microextraction-ion mobility spectrometry. | Analytical chemistry 20050915 |
| A review of the endocrine activity of parabens and implications for potential risks to human health. | Critical reviews in toxicology 20050601 |
| Optimization by experimental design and artificial neural networks of the ion-interaction reversed-phase liquid chromatographic separation of twenty cosmetic preservatives. | Journal of chromatography. A 20040312 |
| Acaricidal activity of tonka bean extracts. Synthesis and structure-activity relationships of bioactive derivatives. | Journal of natural products 20030501 |
| Oestrogenic activity of benzylparaben. | Journal of applied toxicology : JAT 20030101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.