| Record Information |
|---|
| Version | 1.0 |
|---|
| Created at | 2020-04-27 16:40:43 UTC |
|---|
| Updated at | 2021-01-04 18:49:01 UTC |
|---|
| CannabisDB ID | CDB005638 |
|---|
| Secondary Accession Numbers | Not Available |
|---|
| Cannabis Compound Identification |
|---|
| Common Name | 5-Ethyl-2-vinylpyridine |
|---|
| Description | 5-Ethyl-2-vinylpyridine, belongs to the class of organic compound known as pyridines and derivatives. These are compounds containing a pyridine ring, which is a six-member aromatic heterocycle which consists of one nitrogen atom and five carbon atoms. 5-Ethyl-2-vinylpyridine is one of several structural isomers of ethylvinylpyridine which is substituted by one ethyl and one vinyl groups at different positions of the pyridine ring. It exists as a clear, slightly yellow liquid that is insoluble in water. 5-Ethyl-2-vinylpyridine is one of the components that contribute to the nutty, roasted aroma in the Parmigiano-Reggiano cheese. It has been reported to be found in dry red beans, cocoa, tea, whiskey, peppermint oil, roasted and fried chicken, cocoa, coffee and cooked shrimps. It has a sharp, penetrating aromatic odor. 5-Ethyl-2-vinylpyridine is also found in marijuana smoke and is formed during the combustion of cannabis ( Ref:DOI ). |
|---|
| Structure | |
|---|
| Synonyms | Not Available |
|---|
| Chemical Formula | C9H11N |
|---|
| Average Molecular Weight | 133.19 |
|---|
| Monoisotopic Molecular Weight | 133.0891 |
|---|
| IUPAC Name | 2-ethenyl-5-ethylpyridine |
|---|
| Traditional Name | pyridine, 5-ethyl-2-vinyl- |
|---|
| CAS Registry Number | 5408-74-2 |
|---|
| SMILES | CCC1=CN=C(C=C)C=C1 |
|---|
| InChI Identifier | InChI=1S/C9H11N/c1-3-8-5-6-9(4-2)10-7-8/h4-7H,2-3H2,1H3 |
|---|
| InChI Key | YQUDMNIUBTXLSX-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Description | Belongs to the class of organic compounds known as pyridines and derivatives. Pyridines and derivatives are compounds containing a pyridine ring, which is a six-member aromatic heterocycle which consists of one nitrogen atom and five carbon atoms. |
|---|
| Kingdom | Organic compounds |
|---|
| Super Class | Organoheterocyclic compounds |
|---|
| Class | Pyridines and derivatives |
|---|
| Sub Class | Not Available |
|---|
| Direct Parent | Pyridines and derivatives |
|---|
| Alternative Parents | |
|---|
| Substituents | - Pyridine
- Heteroaromatic compound
- Azacycle
- Organic nitrogen compound
- Organopnictogen compound
- Hydrocarbon derivative
- Organonitrogen compound
- Aromatic heteromonocyclic compound
|
|---|
| Molecular Framework | Aromatic heteromonocyclic compounds |
|---|
| External Descriptors | Not Available |
|---|
| Ontology |
|---|
|
Not Available | | Physical Properties |
|---|
| State | Not Available |
|---|
| Experimental Properties | | Property | Value | Reference |
|---|
| Melting Point | Not Available | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | logP | Not Available | Not Available |
|
|---|
| Predicted Properties | [] |
|---|
