| Sonrisas canónicas | CC(C)C(C#C)O |
|---|---|
| IUPAC Name | 4-methylpent-1-yn-3-ol |
| InChIKey | UTIFIONYBLSHIL-UHFFFAOYSA-N |
| INCHI | 1S/C6H10O/c1-4-6(7)5(2)3/h1,5-7H,2-3H3 |
| Isómeros SMILES | CC(C)C(C#C)O |
| Peso molecular | 98.15 |
| Reaxy-Rn | 1698762 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1698762&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic oxygen compounds |
| Clase | Organooxygen compounds |
| Subclass | Alcohols and polyols |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Secondary alcohols |
| Alternative Parents | Acetylides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Secondary alcohol - Acetylide - Hydrocarbon derivative - Aliphatic acyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl). |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
 G2504427 | Certificate of Analysis | Jun 28, 2025 | M300342 |
| G2504428 | Certificate of Analysis | Jun 28, 2025 | M300342 |
| G2504429 | Certificate of Analysis | Jun 28, 2025 | M300342 |
| G2504430 | Certificate of Analysis | Jun 28, 2025 | M300342 |
| G2504431 | Certificate of Analysis | Jun 28, 2025 | M300342 |
| G2504432 | Certificate of Analysis | Jun 28, 2025 | M300342 |
| Solubilidad | Slightly soluble in water. |
|---|---|
| Índice de refracción | 1.4360 |
| Punto de inflamación (°F) | 105°F |
| Punto de inflamación (°C) | 41℃ |
| Punto de fusión (°C) | 133-134℃ |
| Peso molecular | 98.140 g/mol |
| XLogP3 | 1.000 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 98.0732 Da |
| Monoisotopic Mass | 98.0732 Da |
| Topological Polar Surface Area | 20.200 Ų |
| Heavy Atom Count | 7 |
| Formal Charge | 0 |
| Complexity | 85.600 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
