2432-51-1
Product Name:
Methyl thiobutyrate
Formula:
C5H10OS
Synonyms:
S-Methyl thiobutanoate;S-Methyl thiobutyrate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Liquid |
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Boiling Point | 142.00 to 143.00 °C. @ 757.00 mm Hg |
Solubility | insoluble in water; miscible in diethyl ether |
Density | 0.960-0.975 |
Refractive Index | 1.457-1.469 |
Kovats Retention Index | 867 863 870 869 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Flame Flammables GHS02 Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H226:Flammable liquids H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P233:Keep container tightly closed. P240:Ground/bond container and receiving equipment. P241:Use explosion-proof electrical/ventilating/lighting/…/equipment. P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
Molecular Weight | 118.20 g/mol |
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XLogP3 | 1.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 3 |
Exact Mass | 118.04523611 g/mol |
Monoisotopic Mass | 118.04523611 g/mol |
Topological Polar Surface Area | 42.4 Ų |
Heavy Atom Count | 7 |
Formal Charge | 0 |
Complexity | 61.1 |
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
S-Methyl butanethioate is a thiocarboxylic ester.