13532-18-8
Product Name:
Methyl 3-methylthiopropionate
Formula:
C5H10O2S
Synonyms:
Methyl 3-(methylmercapto)propionate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Liquid |
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Boiling Point | 74.00 to 75.00 °C. @ 13.00 mm Hg |
Solubility | very slightly |
Density | 1.069-1.078 |
Refractive Index | 1.462-1.468 |
Kovats Retention Index | 992.4 1001 1000 992 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Flame Flammables GHS02 |
GHS Hazard Statements |
H227:Flammable liquids |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P280:Wear protective gloves/protective clothing/eye protection/face protection. P370+P378:In case of fire: Use … for extinction. P403+P235:Store in a well-ventilated place. Keep cool. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
Molecular Weight | 134.20 g/mol |
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XLogP3 | 0.7 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 4 |
Exact Mass | 134.04015073 g/mol |
Monoisotopic Mass | 134.04015073 g/mol |
Topological Polar Surface Area | 51.6 Ų |
Heavy Atom Count | 8 |
Formal Charge | 0 |
Complexity | 72.8 |
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
Methyl 3-(methylthio)propanoate is a carboxylic ester.