Home Other Building Blocks 13679-85-1
13679-85-1,MFCD00078280
Catalog No.:AA0012AO

13679-85-1 | 2-Methyltetrahydrothiophen-3-one

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1g
97%
in stock  
$16.00   $11.00
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5g
97%
in stock  
$27.00   $19.00
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100g
97%
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$211.00   $148.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0012AO
Chemical Name:
2-Methyltetrahydrothiophen-3-one
CAS Number:
13679-85-1
Molecular Formula:
C5H8OS
Molecular Weight:
116.1814
MDL Number:
MFCD00078280
SMILES:
O=C1CCSC1C
FEMA Number:
3512
Properties
Computed Properties
 
Complexity:
90.1  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Undefined Atom Stereocenter Count:
1  
XLogP3:
0.8  

Downstream Synthesis Route

[1]Schmid;Schnetzler[HelveticaChimicaActa,1951,vol.34,p.894,896]

[1]Buchman;Cohen[JournaloftheAmericanChemicalSociety,1944,vol.66,p.847]Karrer;Schmid[HelveticaChimicaActa,1944,vol.27,p.124,126]

[1]Mosandl,Armin;Hener,Uwe;Fenske,Heinz-Dieter[LiebigsAnnalenderChemie,1989,p.859-862]

13679-85-1   
CASUnavailable 
  62614-77-1    121153-33-1 

[1]Mosandl,Armin;Hener,Uwe;Fenske,Heinz-Dieter[LiebigsAnnalenderChemie,1989,p.859-862]

[1]Mosandl,Armin;Hener,Uwe;Fenske,Heinz-Dieter[LiebigsAnnalenderChemie,1989,p.859-862]

Literature

Title: Characterization of odor-active compounds in guava wine.

Journal: Journal of agricultural and food chemistry 20110511

Title: The biosynthesis of the aroma volatile 2-methyltetrahydrothiophen-3-one in the bacterium Chitinophaga Fx7914.

Journal: Chembiochem : a European journal of chemical biology 20100903

Title: Production of volatile organic compounds (VOCs) by yeasts isolated from the ascocarps of black (Tuber melanosporum Vitt.) and white (Tuber magnatum Pico) truffles.

Journal: Archives of microbiology 20051101

Title: Alcohols, esters and heavy sulphur compounds production by pure and mixed cultures of apiculate wine yeasts.

Journal: International journal of food microbiology 20050915

Title: GC-olfactometric characterization of aroma volatiles from the thermal degradation of thiamin in model orange juice.

Journal: Journal of agricultural and food chemistry 20030507

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