103-41-3 | Benzyl cinnamate

Packsize	Purity	Availability	Price	Discounted Price
1g	95%	in stock	$15.00	$10.00
25g	95%	in stock	$19.00	$13.00
100g	95%	in stock	$30.00	$21.00
500g	95%	in stock	$94.00	$66.00
5kg	95%	in stock	$733.00	$513.00
10kg	95%	in stock	$1,153.00	$807.00
25kg	95%	in stock	$2,516.00	$1,762.00
50kg	95%	in stock	$4,745.00	$3,322.00
180kg	95%	in stock	$11,131.00	$7,792.00

Description

• Catalog Number: AB71018
• Chemical Name: Benzyl cinnamate
• CAS Number: 103-41-3
• Molecular Formula: C16H14O2
• Molecular Weight: 238.2812
• MDL Number: MFCD00004789
• SMILES: O=C(/C=C/c1ccccc1)OCc1ccccc1

Computed Properties

• Complexity: 271
• Covalently-Bonded Unit Count: 1
• Defined Bond Stereocenter Count: 1
• Heavy Atom Count: 18
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• XLogP3: 3.8

Upstream Synthesis Route

Benzyl cinnamate plays a crucial role in chemical synthesis processes as a versatile compound that offers unique reactivity and functionality. Its application in organic synthesis primarily involves its use as a key ingredient in the production of various fragrances and flavors due to its pleasant aroma and flavor profile. Additionally, benzyl cinnamate serves as a valuable starting material for the synthesis of other important compounds in the pharmaceutical and cosmetic industries. Its ability to undergo different chemical reactions, such as esterification, oxidation, and reduction, makes it a valuable building block in the creation of a wide range of products. In particular, benzyl cinnamate is commonly utilized in the synthesis of sunscreen agents, insect repellents, and antimicrobial compounds, showcasing its significance in designing novel molecules with desirable properties. Furthermore, its structural features make it a critical component in the development of advanced materials and polymers, highlighting its diverse applications and importance in the field of chemical synthesis.

Literature

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  The Journal of toxicological sciences 20180101

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

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

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  Chemico-biological interactions 20160725

• Relating skin sensitizing potency to chemical reactivity: reactive Michael acceptors inhibit NF-κB signaling and are less sensitizing than S(N)Ar- and S(N)2- reactive chemicals.

  Chemical research in toxicology 20111121

• Novel natural product-based cinnamates and their thio and thiono analogs as potent inhibitors of cell adhesion molecules on human endothelial cells.

  European journal of medicinal chemistry 20111101

• Propolis specimens from different locations of central Italy: chemical profiling and gas chromatography-mass spectrometry (GC-MS) quantitative analysis of the allergenic esters benzyl cinnamate and benzyl salicylate.

  Journal of agricultural and food chemistry 20110112

• A new in vitro method for identifying chemical sensitizers combining peptide binding with ARE/EpRE-mediated gene expression in human skin cells.

  Cutaneous and ocular toxicology 20100901

• Study on the constituents of Mexican propolis and their cytotoxic activity against PANC-1 human pancreatic cancer cells.

  Journal of natural products 20100423

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  Bioorganic & medicinal chemistry 20080815

• Fragrance material review on benzyl cinnamate.

  Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20070101

• Esters, amides and substituted derivatives of cinnamic acid: synthesis, antimicrobial activity and QSAR investigations.

  European journal of medicinal chemistry 20041001

• Acaricidal activity of tonka bean extracts. Synthesis and structure-activity relationships of bioactive derivatives.

  Journal of natural products 20030501