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93-99-2,MFCD00003072
Catalog No.:AA003TM4

93-99-2 | Phenyl benzoate

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5g
99%
in stock  
$6.00   $4.00
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25g
99%
in stock  
$18.00   $13.00
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100g
>99.0%(GC)
in stock  
$70.00   $49.00
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500g
>99.0%(GC)
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$310.00   $217.00
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  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003TM4
Chemical Name:
Phenyl benzoate
CAS Number:
93-99-2
Molecular Formula:
C13H10O2
Molecular Weight:
198.2173
MDL Number:
MFCD00003072
SMILES:
O=C(c1ccccc1)Oc1ccccc1
NSC Number:
37086
Properties
Properties
 
BP:
314.0±11.0°C at 760 mmHg  
Form:
Solid  
MP:
68-70 °C  
Refractive Index:
1.5954 (estimate)  
Solubility:
alcohol: freely soluble (hot)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
201  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
3.6  

Literature

Title: An in vitro skin sensitization assay termed EpiSensA for broad sets of chemicals including lipophilic chemicals and pre/pro-haptens.

Journal: Toxicology in vitro : an international journal published in association with BIBRA 20170401

Title: SENS-IS, a 3D reconstituted epidermis based model for quantifying chemical sensitization potency: Reproducibility and predictivity results from an inter-laboratory study.

Journal: Toxicology in vitro : an international journal published in association with BIBRA 20160401

Title: Chemical allergens stimulate human epidermal keratinocytes to produce lymphangiogenic vascular endothelial growth factor.

Journal: Toxicology and applied pharmacology 20150301

Title: Palladium-catalyzed alkenylation and alkynylation of ortho-C(sp2)-H bonds of benzylamine picolinamides.

Journal: Organic letters 20120615

Title: B cell increases and ex vivo IL-2 production as secondary endpoints for the detection of sensitizers in non-radioisotopic local lymph node assay using flow cytometry.

Journal: Toxicology letters 20120325

Title: 2-Amino-3-(hy-droxy-meth-yl)pyridinium 2-benzoyl-benzoate monohydrate.

Journal: Acta crystallographica. Section E, Structure reports online 20120301

Title: 2-Oxo-2H-chromen-4-yl 4-tert-butyl-benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20120201

Title: C-H⋯π packing inter-actions in 2-[5,5-bis-(4-benzyl-oxyphen-yl)-3-cyano-4-methyl-2,5-dihydro-furan-2-yl-idene]malononitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20111101

Title: 2-(1,3-Benzoxazol-2-yl)-1-phenyl-ethenyl benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20111001

Title: Phenyl 3,5-di-tert-butyl-2-hy-droxy-benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20101201

Title: Facile benzo-ring construction via palladium-catalyzed functionalization of unactivated sp3 C-H bonds under mild reaction conditions.

Journal: Organic letters 20100806

Title: 2,4-Dimethyl-phenyl 4-methyl-benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20091101

Title: Phenyl 4-methyl-benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20091101

Title: Ethyl 2-(4-benzoyl-2,5-dimethyl-phen-oxy)acetate.

Journal: Acta crystallographica. Section E, Structure reports online 20091101

Title: A plasmacytoid dendritic cell (CD123+/CD11c-) based assay system to predict contact allergenicity of chemicals.

Journal: Toxicology 20091001

Title: Triphenyl-methyl benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20090801

Title: Simultaneous determination of 21 preservatives in cosmetics by ultra performance liquid chromatography.

Journal: International journal of cosmetic science 20081001

Title: Synthesis and spectroscopic examination of various substituted 1,3-dibenzoylmethane, active agents for UVA/UVB photoprotection.

Journal: Journal of photochemistry and photobiology. B, Biology 20080821

Title: Use of an ex vivo local lymph node assay to assess contact hypersensitivity potential.

Journal: Journal of immunotoxicology 20080701

Title: 2,6-Dichloro-phenyl 4-methyl-benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20080501

Title: 2,3-Dimethyl-phenyl benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20080501

Title: 4-Bromo-phenyl benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20080401

Title: Unravelling the ultrafast photodecomposition mechanism of dibenzoyl peroxide in solution by time-resolved IR spectroscopy.

Journal: Physical chemistry chemical physics : PCCP 20080328

Title: A new classification system for bacterial Rieske non-heme iron aromatic ring-hydroxylating oxygenases.

Journal: BMC biochemistry 20080101

Title: Aromatic compound degradation by iron reducing bacteria isolated from irrigated tropical paddy soils.

Journal: Journal of environmental sciences (China) 20080101

Title: tert-Butyl 4-({[(E)-1,3-dimethyl-5-phen-oxy-pyrazol-4-yl]meth-yl}amino-oxymeth-yl)benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20080101

Title: 4-Methyl-phenyl 4-chloro-benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20080101

Title: Instabilities across the isotropic conductivity point in a nematic phenyl benzoate under AC driving.

Journal: The journal of physical chemistry. B 20070802

Title: Drifting undulations in an achiral smectic C liquid crystal driven by a static electric field.

Journal: The journal of physical chemistry. B 20070315

Title: The search of the target of promotion: Phenylbenzoate esterase activities in hen peripheral nerve.

Journal: Toxicology and applied pharmacology 20070301

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: HIV-1 integrase inhibition of biscoumarin analogues.

Journal: Chemical & pharmaceutical bulletin 20060501

Title: Inductive effect-assisted chain-growth polycondensation. synthetic development from para- to meta-substituted aromatic polyamides with low polydispersities.

Journal: Journal of the American Chemical Society 20050727

Title: Density functional theory study of the conformational space of phenyl benzoate, a common fragment in many mesogenic molecules.

Journal: The journal of physical chemistry. A 20050721

Title: Ab initio study of phenyl benzoate: structure, conformational analysis, dipole moment, IR and Raman vibrational spectra.

Journal: Journal of molecular modeling 20030801

Title: Novel radical compounds bearing mesogenic cores with long alkyl substituents.

Journal: The Journal of organic chemistry 20030307

Title: 4-[18F]fluoroarylalkylethers via an improved synthesis of n.c.a. 4-[18F]fluorophenol.

Journal: Nuclear medicine and biology 20020201

Title: Effects of molecular structure on the stability of a thermotropic liquid crystal. Gas electron diffraction study of the molecular structure of phenyl benzoate.

Journal: Journal of the American Chemical Society 20010704

Title: Analysis for organic residues from aids to polymerization used to make plastics intended for food contact.

Journal: Food additives and contaminants 20010501

Title: Analysis of diacyl peroxides by Ag+ coordination ionspray tandem mass spectrometry: free radical pathways of complex decomposition.

Journal: Journal of the American Society for Mass Spectrometry 20010401

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Tags:93-99-2 Molecular Formula|93-99-2 MDL|93-99-2 SMILES|93-99-2 Phenyl benzoate |Organic_Building_Blocks