| Record Information |
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| Version | 1.0 |
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| Creation date | 2015-10-09 22:31:46 UTC |
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| Update date | 2017-01-19 02:36:31 UTC |
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| FoodComEx ID | PC000651 |
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| FoodDB Record | FDB022462 |
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| Chemical Information |
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| Name | 4-Aminophenol |
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| Description | 4-aminophenol is considered a minor nephrotoxic metabolite of phenacetin and acetaminophen (paracetamol) in man.
4-Aminophenol can undergo autoxidations and metal-catalyzed and enzymatic oxidations in man to produce reactive oxygen species. (PMID 1713494) [HMDB] |
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| CAS Number | 123-30-8 |
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| Structure | |
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| Synonyms | | Synonym | Source |
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| 1-Amino-4-hydroxybenzene | hmdb | | 4-Amino-1-hydroxybenzene | hmdb | | 4-Aminobenzenol | hmdb | | 4-Aminophenol | hmdb | | 4-Hydroxyaniline | hmdb | | Aminophenol | hmdb | | Energol | hmdb | | Fouramine P | hmdb | | p-Aminophenol | hmdb | | p-Hydroxyaniline | hmdb | | p-Hydroxyphenylamine | hmdb | | Paramidophenol | hmdb |
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| Chemical Formula | C6H7NO |
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| IUPAC name | 4-aminophenol |
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| InChI Identifier | InChI=1S/C6H7NO/c7-5-1-3-6(8)4-2-5/h1-4,8H,7H2 |
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| InChI Key | PLIKAWJENQZMHA-UHFFFAOYSA-N |
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| Isomeric SMILES | NC1=CC=C(O)C=C1 |
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| Average Molecular Weight | 109.1259 |
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| Monoisotopic Molecular Weight | 109.052763851 |
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| Chemical Taxonomy |
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| Description | Belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety. |
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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 | Aniline and substituted anilines |
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| Direct Parent | Aniline and substituted anilines |
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| Alternative Parents | |
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| Substituents | - P-aminophenol
- Aniline or substituted anilines
- Aminophenol
- 1-hydroxy-2-unsubstituted benzenoid
- Phenol
- Organic nitrogen compound
- Organic oxygen compound
- Organopnictogen compound
- Hydrocarbon derivative
- Primary amine
- Organooxygen compound
- Organonitrogen compound
- Amine
- 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 5 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 | I924 |
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| AKSci | J90129 |
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| Glentham | GK8970 |
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| MetaSci | HMDB0001169 |
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| Toronto Research Chemicals | A618920 |
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