phenethyl caffeate

2-propenoic acid, 3-(3,4-dihydroxyphenyl)-, 2-phenylethyl ester

CAS: 104594-70-9 C17 H16 O4 MW: 284.31132000

Identification

Namephenethyl caffeate
IUPAC2-phenylethyl 3-(3,4-dihydroxyphenyl)prop-2-enoate
CAS Number104594-70-9
FDA UNIIG960R9S5SK
Molecular FormulaC17 H16 O4
Molecular Weight284.31132000
MDL NumberMFCD00866470
XlogP34.20 (est)

Regulatory

Physical Properties

Appearance white solid (est)
Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Boiling Point 498.57 °C. @ 760.00 mm Hg (est)
Flash Point 365.00 °F. TCC ( 185.10 °C. ) (est)
logP (o/w) 3.734 (est)
Soluble in alcohol
Insoluble in water

Cosmetic Information

CosIngcosmetic data
Cosmetic Usesantioxidants

No sensory data available

Safety Information

Preferred SDSView
Oral/Parenteral ToxicityNot determined
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categoryantioxidants
Recommendation for phenethyl caffeate usage levels up tonot for fragrance use.
Recommendation for phenethyl caffeate flavor usage levels up tonot for flavor use.

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Potential Uses

None Found

Natural Occurrence

found in nature

Synonyms

caffeic acid 2-phenylethyl ester caffeic acid phenethyl ester 3-(3,4- dihydroxy-phenyl)-acrylic acid phenethyl ester phenethyl 3-(3,4-dihydroxyphenyl)prop-2-enoate 2- phenyl ethyl 3-(3,4-dihydroxyphenyl)-2-propenoate phenyl ethyl caffeate 2- phenylethyl 3-(3,4-dihydroxyphenyl)acrylate 2- phenylethyl 3-(3,4-dihydroxyphenyl)prop-2-enoate phenylethyl caffeate 2- phenylethyl caffeate 2- propenoic acid, 3-(3,4-dihydroxyphenyl)-, 2-phenylethyl ester PubMed: Propolis from northern California and Oregon: chemical composition, botanical origin, and content of allergens. PubMed: Discovery of bile salt hydrolase inhibitors using an efficient high-throughput screening system. PubMed: Phenethyl caffeate benzoxanthene lignan is a derivative of caffeic acid phenethyl ester that induces bystander autophagy in WiDr cells. PubMed: High-throughput chemical screens identify disulfiram as an inhibitor of human glioblastoma stem cells. PubMed: Phenethyl caffeate benzo[kl]xanthene lignan with DNA interacting properties induces DNA damage and apoptosis in colon cancer cells. PubMed: In vitro antitrypanosomal activity of some phenolic compounds from propolis and lactones from Fijian Kawa (Piper methysticum). PubMed: Inhibitory effects of caffeic acid ester analogues on free radicals and human liver microsome CYP1A2 activities. PubMed: p52-Bcl3 complex promotes cyclin D1 expression in BEAS-2B cells in response to low concentration arsenite. PubMed: Selective analysis of phenolic compounds in propolis by HPLC-MS/MS. PubMed: A new amide from Thyrocarpus glochidiatus. PubMed: Allergic contact dermatitis from propolis. PubMed: Evaluation of the main contact allergens in propolis (1995 to 2005). PubMed: Chlorogenate hydrolase-catalyzed synthesis of hydroxycinnamic acid ester derivatives by transesterification, substitution of bromine, and condensation reactions. PubMed: Antioxidant activity and constituents of propolis collected in various areas of Korea. PubMed: Constituents of Chinese propolis and their antiproliferative activities. PubMed: Inhibitory effect of caffeic acid esters on azoxymethane-induced biochemical changes and aberrant crypt foci formation in rat colon. PubMed: Effect of caffeic acid esters on carcinogen-induced mutagenicity and human colon adenocarcinoma cell growth. PubMed: Propolis allergy (IV). Studies with further sensitizers from propolis and constituents common to propolis, poplar buds and balsam of Peru. PubMed: Propolis allergy. (III). Sensitization studies with minor constituents.