5271-38-5
Product Name:
2-(METHYLTHIO)ETHANOL
Formula:
C3H8OS
Synonyms:
2-(Methylmercapto)ethanol;2-Hydroxyethyl methyl sulfide
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CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | colourless to pale yellow liquid; powerful meat-like aroma |
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Boiling Point | 169.00 to 171.00 °C. @ 760.00 mm Hg |
Solubility | Insoluble in water; soluble in non-polar solvents |
Density | 1.055-1.065 (20°) |
Refractive Index | 1.490-1.498 |
Kovats Retention Index | 810 813 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H227:Flammable liquids H302:Acute toxicity,oral H332:Acute toxicity,inhalation |
Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing. |
COMPUTED DESCRIPTORS
Molecular Weight | 92.16 g/mol |
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XLogP3 | 0.2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 2 |
Exact Mass | 92.02958605 g/mol |
Monoisotopic Mass | 92.02958605 g/mol |
Topological Polar Surface Area | 45.5 Ų |
Heavy Atom Count | 5 |
Formal Charge | 0 |
Complexity | 16.4 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
2-methylthioethanol is a primary alcohol that is the S-methyl derivative of mercaptoethanol. It is found as a volatile component in Cucumis melo Var. cantalupensis. It has a role as a xenobiotic metabolite and a plant metabolite. It is an aliphatic sulfide and a primary alcohol. It is functionally related to a mercaptoethanol.