870-23-5
Product Name:
Allyl mercaptan
Formula:
C3H6S
Synonyms:
2-Propene-1-thiol;Allyl mercaptan
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Clear light brown liquid with a stench; [Sigma-Aldrich MSDS] |
|---|---|
| Boiling Point | 65.00 to 67.00 °C. @ 760.00 mm Hg |
| Solubility | slightly soluble in water; miscible in alcohol, oil, and ethyl ether |
| Density | 0.888-0.930 |
| Vapor Pressure | 524.0 [mmHg] |
| Refractive Index | 1.470-1.491 |
| Kovats Retention Index | 580 583 579 575 |
| Chemical Classes | Other Classes -> Sulfur Compounds |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02  Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H225:Flammable liquids H319:Serious eye damage/eye 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. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. 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 | 74.15 g/mol |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 74.01902136 g/mol |
| Monoisotopic Mass | 74.01902136 g/mol |
| Topological Polar Surface Area | 1 Ų |
| Heavy Atom Count | 4 |
| Formal Charge | 0 |
| Complexity | 17.2 |
| 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
2-Propene-1-thiol is an alkanethiol.