1,4-pentadien-3-one
divinyl ketone
 
Notes:
None found
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CAS Number: 1890-28-4Picture of molecule3D/inchi
FDA UNII: F5WPQ70H2L
Nikkaji Web: J150.179H
XlogP3-AA: 1.10 (est)
Molecular Weight: 82.10202000
Formula: C5 H6 O
NMR Predictor: Predict (works with chrome or firefox)
Category: information only not used for fragrances or flavors
 
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Soluble in:
 water, 2.891e+004 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
 None found
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Safety Information:
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: information only not used for fragrances or flavors
Recommendation for 1,4-pentadien-3-one usage levels up to:
 not for fragrance use.
 
Recommendation for 1,4-pentadien-3-one flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 543199
National Institute of Allergy and Infectious Diseases: Data
 penta-1,4-dien-3-one
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References:
 penta-1,4-dien-3-one
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 543199
Pubchem (sid): 251875621
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Other Information:
(IUPAC): Atomic Weights of the Elements 2011 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
HMDB (The Human Metabolome Database): Search
ChemSpider: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 divinyl ketone
 penta-1,4-dien-3-one
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Articles:
PubMed: Synthesis, anti-tobacco mosaic virus and cucumber mosaic virus activity, and 3D-QSAR study of novel 1,4-pentadien-3-one derivatives containing 4-thioquinazoline moiety.
PubMed: Antiviral activity and interaction mechanisms study of novel glucopyranoside derivatives.
PubMed: Design, synthesis, antiviral activity and three-dimensional quantitative structure-activity relationship study of novel 1,4-pentadien-3-one derivatives containing the 1,3,4-oxadiazole moiety.
PubMed: Synthesis, photophysical studies, solvatochromic analysis and TDDFT calculations of diazaspiro compounds.
PubMed: Design, synthesis, and antiviral activity of novel rutin derivatives containing 1, 4-pentadien-3-one moiety.
PubMed: Synthesis and antiviral bioactivity of novel 3-((2-((1E,4E)-3-oxo-5-arylpenta-1,4-dien-1-yl)phenoxy)methyl)-4(3H)-quinazolinone derivatives.
PubMed: Synthesis and biological evaluation of novel 6-chloro-quinazolin derivatives as potential antitumor agents.
PubMed: The role of methoxy group in the Nazarov cyclization of 1,5-bis-(2-methoxyphenyl)-1,4-pentadien-3-one in the gas phase and condensed phase.
PubMed: Curcumin analogue identified as hyaluronan export inhibitor by virtual docking to the ABC transporter MRP5.
PubMed: Curcumin analog 1, 5-bis (2-trifluoromethylphenyl)-1, 4-pentadien-3-one exhibits enhanced ability on Nrf2 activation and protection against acrolein-induced ARPE-19 cell toxicity.
PubMed: Synthesis and antiviral bioactivity of novel (1E, 4E)-1-aryl-5-(2-(quinazolin-4-yloxy)phenyl)-1,4-pentadien-3-one derivatives.
PubMed: Construction of α-amido-indanones via formal allenamide hydroacylation-Nazarov cyclization.
PubMed: Synthesis of 2-(1,5-diaryl-1,4-pentadien-3-ylidene)-hydrazinecarboximidamide hydrochloride catalyzed by p-dodecylbenzenesulfonic acid in aqueous media under ultrasound irradiation.
PubMed: The curcumin analog ca27 down-regulates androgen receptor through an oxidative stress mediated mechanism in human prostate cancer cells.
PubMed: New antitumoral agents I: In vitro anticancer activity and in vivo acute toxicity of synthetic 1,5-bis(4-hydroxy-3-methoxyphenyl)-1,4-pentadien-3-one and derivatives.
PubMed: Symmetrical alpha-bromoacryloylamido diaryldienone derivatives as a novel series of antiproliferative agents. Design, synthesis and biological evaluation.
PubMed: Ultrasound promoted one-pot synthesis of 3-aza-6,10-diaryl-2-oxa-spiro[4.5]decane-1,4,8-trione.
PubMed: Evaluation of anti-inflammatory effect of synthetic 1,5-bis(4-acetoxy-3-methoxyphenyl)-1,4-pentadien-3-one, HB2.
PubMed: Cyclization of cross-conjugated trienes: the vinylogous Nazarov reaction.
PubMed: Curcumin in cancer management: recent results of analogue design and clinical studies and desirable future research.
PubMed: [Synthesis and anti-inflammatory activity of hydroxylated E,E-1-(3'-indolyl)-5-(substituted phenyl)-1,4-pentadien-3-one derivatives].
PubMed: Activation of NFkappaB is inhibited by curcumin and related enones.
PubMed: Synthesis of 1,1-disubstituted-2,6-diarylcyclohexane-4-ones catalyzed by KF/basic Al2O3 under ultrasound.
PubMed: About the conformations of alpha,beta-diunsaturated ketones.
PubMed: Discovery of natural products from Curcuma longa that protect cells from beta-amyloid insult: a drug discovery effort against Alzheimer's disease.
PubMed: [Not Available].
PubMed: [Reactions of 1,4-pentadien-3-ones. 10. The reaction of 1,5-diphenyl-1,4-pentadien-3-one with malondinitrile].
PubMed: [STUDIES ON NITROFURAN AND RELATED COMPOUNDS FOR MEDICINAL PURPOSE. II. HYDROLYSIS OF 1,5-BIS(5-NITRO-2-FURYL)-1,4-PENTADIEN-3-ONE AMIDINOHYDRAZONE AND ITS CYCLIZED PRODUCT].
PubMed: [STUDIES ON NITROFURAN AND RELATED COMPOUNDS FOR MEDICINAL PURPOSE. I. CYCLIZATION OF 1,5-BIS(5-NITRO-2-FURYL)-1,4-PENTADIEN-3-ONE AMIDINOHYDRAZONE AND RELATED COMPOUNDS].
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