methyl 4-(methyl thio) butyrate

Full Material List
methyl 4-methylsulfanylbutanoate

Identifiers

FEMA 3412
CAS 53053-51-3
EINECS 258-328-7
Synonyms
  • butanoic acid, 4-(methylthio)-, methyl ester
  • methyl 4-(methyl mercapto) butyrate
  • methyl 4-(methyl thio) butanoate
  • methyl 4-(methylmercapto)butyrate
  • methyl 4-(methylsulfanyl)butanoate
  • methyl 4-(methylthio) butyrate
  • methyl 4-(methylthio)butanoate
  • methyl 4-(methylthio)butyrate
  • methyl 4-(methylthio)butyrate (10% in triacetin)
  • methyl 4-(methylthio)butyrate 10% solution in triacetin
  • methyl 4-(methylthio)butyrate pure
  • methyl 4-methylsulfanylbutanoate
  • methyl 4-methylthiobutyrate
  • methyl gamma-(methyl thio) butyrate
  • methyl gamma-methyl mercaptobutyrate
  • methyl gamma-methyl thiobutyrate
  • 4-( methylthio)butyric acid methyl ester
JECFA Food Flavoring 474
JECFA Food Additive N/A
DG SANTE Food Flavourings 12.060 methyl 4-(methylthio)butyrate
DG SANTE Food Contact Materials N/A
FDA UNII 36I1Z35638
CoE Number 11526
XlogP3-AA 1.40 (est)
Molecular Weight 148.22504
Molecular Formula C6 H12 O2 S

Organoleptic

Organoleptic Notes
  • 1. Odor Type: sulfurous Odor Strength:high ,recommend smelling in a 0.10 % solution or less
  • Substantivity:196 hour(s) at 100.00 %
  • sulfurous cabbage fruity pineapple cheesy
  • Odor Description:at 0.10 % in propylene glycol. sulfury cabbage fruity pineapple cheeseLuebke, William tgsc, (1996)
  • Odor sample from: Sigma-Aldrich
Odor sulfurous
sulfurous, cabbage, fruity, pineapple, cheesy,
Flavor sulfurous
sulfurous, garlic, onion, green, chive, cheesy,

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Properties

Food Chemicals Codex Listed No
Appearance colorless clear liquid (est)
Assay 98.00 to 100.00
Specific Gravity N/A
Lbs/Gal (est) N/A
Refractive Index N/A
Melting Point N/A
Boiling Point N/A
Flash Point 185.00 °F. TCC ( 85.00 °C. )
Acid Value N/A
Vapor Pressure 0.311000 mmHg @ 25.00 °C. (est)
Vapor Density >1 ( Air = 1 )
logP (o/w) 1.225 (est)
Soluble In
  • alcohol
  • water, 4534 mg/L @ 25 °C (est)
Occurrence
  • ananas comosus fruit