| Record Information |
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| Version | 1.0 |
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| Created at | 2020-04-27 16:44:39 UTC |
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| Updated at | 2021-01-04 18:49:08 UTC |
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| CannabisDB ID | CDB005677 |
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| Secondary Accession Numbers | Not Available |
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| Cannabis Compound Identification |
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| Common Name | 1-Phenoxyethanol |
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| Description | 1-Phenoxyethanol also known as phenoxyethanol belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring. 1-Phenoxyethanol is also classified as a glycol ether, a phenol ether, and an aromatic alcohol. There are two known isomers of phenoxyethanol including 1-phenoxyethanol and 2-phenoxyethanol. 1-Phenoxyethanol is the less widely used isomer and less studied than 2-Phenoxyethanol. It is produced by the hydroxyethylation of phenol (Williamson synthesis) in the presence of alkali-metal hydroxides or alkali-metal borohydrides. 1-Phenoxyethanol exhibits antibacterial activity and is effective against gram-negative and gram-positive bacteria, as well as the yeast Candida albicans. 1-Phenoxyethanol is a known constituent of cannabis smoke and is formed during the combustion of cannabis ( Ref:DOI ). |
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| Structure | |
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| Synonyms | Not Available |
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| Chemical Formula | C8H10O2 |
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| Average Molecular Weight | 138.17 |
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| Monoisotopic Molecular Weight | 138.0681 |
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| IUPAC Name | 1-phenoxyethan-1-ol |
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| Traditional Name | 1-phenoxyethanol |
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| CAS Registry Number | 56101-99-6 |
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| SMILES | CC(O)OC1=CC=CC=C1 |
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| InChI Identifier | InChI=1S/C8H10O2/c1-7(9)10-8-5-3-2-4-6-8/h2-7,9H,1H3 |
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| InChI Key | XEFAJZOBODPHBG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Classification | Not classified |
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| Ontology |
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| Not Available |
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| Physical Properties |
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| State | Not Available |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | Not Available | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | logP | Not Available | Not Available |
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| Predicted Properties | [] |
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