CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Clear light yellow liquid; [Sigma-Aldrich MSDS] |
|---|---|
| Boiling Point | 115.00 °C. @ 760.00 mm Hg |
| Melting Point | -69 °C |
| Solubility | 0.4 mg/mL at 25 °C |
| Vapor Pressure | 22.2 [mmHg] |
| LogP | 2.34 |
| Kovats Retention Index | 755 763 760 768 775 759 776 775 775 760 756 759 759 758.8 756 757 756 757 773 |
| Chemical Classes | Other Classes -> Thiophenes |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02 |
| GHS Hazard Statements |
H225:Flammable liquids |
| 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. P242:Use only non-sparking tools. P243:Take precautionary measures against static discharge. |
COMPUTED DESCRIPTORS
| Molecular Weight | 98.17 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 98.01902136 g/mol |
| Monoisotopic Mass | 98.01902136 g/mol |
| Topological Polar Surface Area | 28.2 Ų |
| Heavy Atom Count | 6 |
| Formal Charge | 0 |
| Complexity | 43.2 |
| 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
3-Methylthiophene is a member of thiophenes.