2-Acetyl-5-methylthiophene
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2-Acetyl-5-methylthiophene
structure -
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CAS No:
13679-74-8
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Formula:
C7H8OS
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Chemical Name:
2-Acetyl-5-methylthiophene
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Synonyms:
Ethanone,1-(5-methyl-2-thienyl)-;Ketone,methyl 5-methyl-2-thienyl;1-(5-Methyl-2-thienyl)ethanone;Methyl 5-methyl-2-thienyl ketone;2-Acetyl-5-methylthiophene;2-Methyl-5-acetylthiophene;5-Methyl-2-thienyl methyl ketone;1-(5-Methylthiophen-2-yl)ethanone;1-(5-Methylthiophen-2-yl)ethan-1-one
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CAS No:
Description
white to light yellow crystal powder
Solid|Colourless to pale yellow liqud to crystalline powder at lower temperatures; Roasted aroma with sweet notes
2-Acetyl-5-methylthiophene is an aromatic ketone.
2-Acetyl-5-methylthiophene Basic Attributes
140.2
140.20
110854
237-181-2
2HS3I278W9
DTXSID10159932
29349990
Characteristics
45.3
2
White to pale yellow Low Melting Crystalline Mass, Powder or Crystals
1.12 g/cm3 @ Temp: 25 °C
27.5 °C
232.5 °C
>230 °F
n20/D 1.561(lit.)
Very slightly soluble in water
0.0517mmHg at 25°C
Safety Information
STENCH
UN 3335
3
20/21/22
36/37-22
OB4972000
Xn,Xi
Irritant
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P501
H302
|Warning|H302 (88.89%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 9 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
2-Acetyl-5-methylthiophene Use and Manufacturing
General procedure: The Friedel-Crafts acylation of Anisole (1 g, 9.26 mmol)(Aldrich, 99.0percent) with propionyl chloride (5 equiv.)(Aldrich, 99.0percent) using the prepared MoO4(AlCl22(5 wtpercent, 10 mg) catalyst was carried out in a magneticallystirred two-necked round bottom flask fitted witha guard tube (CaCl2, activated at 150 C for 2 h. Thepresent reaction mixture stirred at room temperature up tothe completion of reaction. Reaction progress was monitoredby thin layer chromatography (TLC). After completionof the reaction, reaction mixture was filtered andsolid catalyst was separated out. The separated solid catalystcan be recycled in next attempt of Friedel-Craftsacylation reaction. The reaction mixture was washed withdichloromethane (DCM) and water, the same process wasdone triplicate and collected the organic layer. The organiclayer was then dried over anhydrous sodium sulfate andconcentrated on rotary evaporator and crude acylated productwas obtained and purified on column chromatography.EXAMPLE 7
Flavouring Agent -> FLAVOURING_AGENT; -> JECFA Functional Classes|Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT;|Flavoring Agents
Computed Properties
Molecular Weight:140.20
XLogP3:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:140.02958605
Monoisotopic Mass:140.02958605
Topological Polar Surface Area:45.3
Heavy Atom Count:9
Complexity:122
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of 2-Acetyl-5-methylthiophene
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Business licensed Certified factoryManufactory Supplier of Active Pharm Ingredients,Chemical Catalyst,Pharmaceutical Intermediates,Flavors and Fragrances,Agrochemicals,Chemical Pesticides,Organic Intermediates,OLED IntermediatesInquiryCAS No.: 13679-74-8Grade: Pharmaceutical GradeContent: 99%
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