| Record Information |
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| Version | 1.0 |
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| Creation date | 2015-10-09 22:33:08 UTC |
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| Update date | 2017-01-19 02:36:39 UTC |
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| FoodComEx ID | PC000867 |
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| FoodDB Record | FDB023373 |
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| Chemical Information |
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| Name | Benzamide |
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| Description | Benzamide is an intermediate in the Benzoate degradation via CoA ligation.
Benzamides are a class of chemical compounds derived from Benzamid, the carbonic acid amide of benzoic acid.
In psychiatry some substituted benzamides are therapeutically used as neuroleptics and/or antipsychotics (wikipedia) [HMDB] |
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| CAS Number | 55-21-0 |
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| Structure | |
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| Synonyms | | Synonym | Source |
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| Amid kyseliny benzoove | HMDB | | Benzamide (acd/name 4.0) | HMDB | | Benzenecarboxamide | hmdb | | Benzoate amide | Generator | | Benzoic acid amide | hmdb | | Benzoylamide | hmdb | | PHC(=O)NH2 | ChEBI | | PHC(O)NH2 | ChEBI | | Phenyl carboxyamide | hmdb | | Phenylcarboxamide | hmdb | | Phenylcarboxyamide | hmdb | | Tigan | HMDB | | Tigan (TN) | hmdb | | Trimethobenzamide hydrochloride | HMDB |
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| Chemical Formula | C7H7NO |
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| IUPAC name | benzamide |
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| InChI Identifier | InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9) |
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| InChI Key | KXDAEFPNCMNJSK-UHFFFAOYSA-N |
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| Isomeric SMILES | NC(=O)C1=CC=CC=C1 |
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| Average Molecular Weight | 121.1366 |
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| Monoisotopic Molecular Weight | 121.052763851 |
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| Chemical Taxonomy |
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| Description | Belongs to the class of organic compounds known as benzamides. These are organic compounds containing a carboxamido substituent attached to a benzene ring. |
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| Kingdom | Organic compounds |
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| Super Class | Benzenoids |
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| Class | Benzene and substituted derivatives |
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| Sub Class | Benzoic acids and derivatives |
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| Direct Parent | Benzamides |
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| Alternative Parents | |
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| Substituents | - Benzamide
- Benzoyl
- Primary carboxylic acid amide
- Carboxamide group
- Carboxylic acid derivative
- Organic nitrogen compound
- Organic oxygen compound
- Organopnictogen compound
- Organic oxide
- Hydrocarbon derivative
- Organooxygen compound
- Organonitrogen compound
- Aromatic homomonocyclic compound
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| Molecular Framework | Aromatic homomonocyclic 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 | Not Available | |
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| Experimental Water Solubility | Not Available | |
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| Melting Point | Not Available | |
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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 2 g |
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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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| AKSci | D850 |
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| Toronto Research Chemicals | B183620 |
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