Record Information |
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Version | 1.0 |
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Creation date | 2015-10-09 22:28:08 UTC |
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Update date | 2017-01-19 02:36:12 UTC |
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FoodComEx ID | PC000086 |
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FoodDB Record | FDB001088 |
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Chemical Information |
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Name | (E)-2-Octenoic acid |
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Description | Food flavourant for baked goods and candies
As to unsaturated acids, those with eight carbon atoms, 2-octenoic acid (trans-8: 1[2]) and 2-octynoic acid (8:::1[2]), increase the susceptibility to infection and fluidity while low concentrations of monounsaturated acids with 14 and 18 carbon atoms, myristoleic acid (cis-14:1[9]) and oleic acid (cis-18:1[9]), reduce both the susceptibility to infection and the fluidity of the membrane. [Pubmed 1963884]. |
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CAS Number | 1871-67-6 |
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Structure | |
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Synonyms | Synonym | Source |
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(2E)-2-Octenoic acid | biospider | (E)-2-Octenoate | biospider | (E)-2-Octenoic acid | biospider | (E)-Oct-2-enoate | biospider | (E)-Oct-2-enoic acid | biospider | 2-Octenoic acid, (2E)- | biospider | 2-Octenoic acid, (E)- | biospider | 2E-octenoic acid | biospider | FEMA 3957 | db_source | trans-2-Octenoate | biospider | trans-2-Octenoic acid | biospider |
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Chemical Formula | C8H14O2 |
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IUPAC name | (2E)-oct-2-enoic acid |
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InChI Identifier | InChI=1S/C8H14O2/c1-2-3-4-5-6-7-8(9)10/h6-7H,2-5H2,1H3,(H,9,10)/b7-6- |
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InChI Key | CWMPPVPFLSZGCY-SREVYHEPSA-N |
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Isomeric SMILES | CCCCC\C=C/C(O)=O |
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Average Molecular Weight | 142.1956 |
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Monoisotopic Molecular Weight | 142.099379692 |
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Chemical Taxonomy |
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Description | Belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms. |
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Kingdom | Organic compounds |
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Super Class | Lipids and lipid-like molecules |
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Class | Fatty Acyls |
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Sub Class | Fatty acids and conjugates |
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Direct Parent | Medium-chain fatty acids |
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Alternative Parents | |
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Substituents | - Medium-chain fatty acid
- Unsaturated fatty acid
- Straight chain fatty acid
- Monocarboxylic acid or derivatives
- Carboxylic acid
- Carboxylic acid derivative
- Organic oxygen compound
- Organic oxide
- Hydrocarbon derivative
- Organooxygen compound
- Carbonyl group
- Aliphatic acyclic compound
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Molecular Framework | Aliphatic acyclic compounds |
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External Descriptors | |
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Physico-Chemical Properties - Experimental |
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Property | Value | Reference |
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Experimental logP | 2.9 | |
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Experimental Water Solubility | Not Available | |
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Melting Point | Mp 2° | DFC |
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Foods of Origin |
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Food | Content Range | Average | Reference |
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Food | | | Reference |
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Production Data |
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Production Method | commercial |
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Production Method Reference | Not Available |
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Production Method Reference File | Not Available |
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Quantity Available | Production upon request, up to 300 mg |
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Delivery Time | Not Available |
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Storage Form | solid |
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Storage Conditions | -80°C |
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Stability | Not Available |
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Purity | Not Available |
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Spectra |
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Spectral Data Upon Request | Not Available |
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Provider Information |
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Commercial Vendors |
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MetaSci | HMDB0000392 |
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Sigma-Aldrich | HMDB0000392 |
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