CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | colourless to pale yellow liquid with green, musky, buchu odour |
|---|---|
| Boiling Point | 63.00 to 65.00 °C. @ 10.00 mm Hg |
| Solubility | insoluble in water; soluble in alcohol |
| Density | 0.994-1.003 |
| Refractive Index | 1.473-1.517 |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02  Corrosion Corrosives GHS05  Skull and Crossbones Acute Toxicity GHS06  Health Hazard GHS08  Environment GHS09 |
| GHS Hazard Statements |
H226:Flammable liquids H318:Serious eye damage/eye irritation H331:Acute toxicity,inhalation H341:Germ cell mutagenicity H400:Hazardous to the aquatic environment, acute hazard |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P308+P313:IF exposed or concerned: Get medical advice/attention. |
COMPUTED DESCRIPTORS
| Molecular Weight | 118.20 g/mol |
|---|---|
| XLogP3 | 0.7 |
| 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 | 54 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
3-(Methylthio)butanal is an aldehyde.