645-68-1

Basic information

• Product Name: 6,9,10-trimethylundeca-3,5,9-trien-2-one
• Synonyms: 6,9,10-trimethylundeca-3,5,9-trien-2-one;6,9,10-Trimethyl-3,5,9-undecatrien-2-one;9-Methylpseudoionone;Pseudoirone;Einecs 211-450-4
• CAS NO: 645-68-1
• Molecular Formula: C₁₄H₂₂O
• Molecular Weight: 206.32388
• EINECS: 211-450-4
• Mol File: 645-68-1.mol
• Article Data: 3

Chemical Properties

• Boiling Point: 316.4°C at 760 mmHg
• Flash Point: 139.2°C
• Appearance: /
• Density: 0.87g/cm³
• Vapor Pressure: 0.000412mmHg at 25°C
• Refractive Index: 1.474
• CAS DataBase Reference: 6,9,10-trimethylundeca-3,5,9-trien-2-one(CAS DataBase Reference)
• NIST Chemistry Reference: 6,9,10-trimethylundeca-3,5,9-trien-2-one(645-68-1)
• EPA Substance Registry System: 6,9,10-trimethylundeca-3,5,9-trien-2-one(645-68-1)

Safety Data

• Hazardous Substances Data: 645-68-1(Hazardous Substances Data)

Usage

InChI:InChI=1/C14H22O/c1-11(2)13(4)10-9-12(3)7-6-8-14(5)15/h6-8H,9-10H2,1-5H3/b8-6+,12-7+

Upstream product

• 78424-77-8 4-Benzenesulfonyl-9,10-dimethyl-6-methylene-undec-9-en-2-one 
• 58307-67-8 3,6,7-trimethyl-6-octen-1-en-3-ol 
• 687-68-3 5,6-dimethyl-5-hepten-2-one 
• 52567-96-1 3,6,7-trimethyl-oct-6-en-1-yn-3-ol 
• 78424-78-9 (2,3-dimethyl-2-butenyl)magnesium chloride 
• 72445-16-0 2-(Chloromethyl)-4-(phenylthio)-1-butene 
• 67-64-1 acetone 
• 64708-55-0 3-Hydroxy-4-isopropenyl-3,6,7-trimethyl-6-octen-1-yne 
• 3899-32-9 (E)-3,6,7-trimethylocta-2,6-dien-1-ol 
• 556-91-2 aluminum tri-tert-butoxide 
• 555-31-7 aluminum isopropoxide 
• 78424-80-3 (6,7-Dimethyl-3-methylene-oct-6-enylsulfanyl)-benzene 
• 64708-53-8 5,6-Dimethyl-3-isopropenyl-2-oxo-5-heptene 
• 37866-06-1 1-chloro-2,3-dimethyl-but-2-ene 

Downstream Products

• 27687-81-6 (+/-)-4t-(2,5,6,6-tetramethyl-cyclohex-1-enyl)-but-3-en-2-one-(2,4-dinitro-phenylhydrazone); (+/-)-trans-β-iron-(2,4-dinitro-phenylhydrazone) 
• 16769-63-4 (+/-)-4-(2,2,3t,6c-tetramethyl-cyclohex-r-yl)-butan-2-one semicarbazone 
• 6138-84-7 (+/-)-4-(2,2,3t,6c-tetramethyl-cyclohex-r-yl)-butan-2-one 
• 79-70-9 β-irone 
• 162282-94-2 1-(1,3,4-trimethyl-3-cyclohexenyl)-1-penten-4-one 
• 79-68-5 gamma-irone 
• 72074-84-1 beta-irone 
• 81456-93-1 (1'RS,5'RS)-4-(2',5',6',6'-tetramethylcyclohex-2'-enyl)butan-2-one 
• 72074-86-3 (+-)-4t-(2,5t,6,6-Tetramethyl-cyclohex-2-en-r-yl)-but-3-en-2-on 
• 72074-85-2 (+-)-4t-(2,5c,6,6-tetramethyl-cyclohex-2-en-r-yl)-but-3-en-2-one 
• 79-69-6 (+/-)-α-Iron 

Relevant articles and documents

TOTAL SYNTHESIS OF IONONES AND IRONES FROM 2-HYDROXYMETHYL-4-PHENYLTHIO-1-BUTENE

A sequence of allylation, the Wacker reaction, and desulfonylation of homoallyl sulfones provided a new synthetic method for the α,β,γ,δ-unsaturated ketone system often encountered in natural products.This procedure was successfully applied to ionone and irone synthesis.

Novel synthesis of dienones and enones from propargyl alcohols and allyl alcohols with 2,2 dimethoxypropane: synthesis of ionone and irone

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