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Record Information |
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| Version |
1.0 |
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| Update Date |
1/22/2018 12:54:54 PM |
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Metabolite ID | PAMDB110413 |
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Identification |
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| Name: |
(2-aminoethyl)phosphonate |
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| Description: | Zwitterionic form of (2-aminoethyl)phosphonic acid. |
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Structure |
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| Synonyms: | -
(2-aminoethane)phosphonate
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ciliatine
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2-aminoethylphosphonate
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2-AEPn
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2-aminoethylphosphonic acid
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phosphonoethylamine
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Chemical Formula: |
C2H8NO3P
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| Average Molecular Weight: |
125.06 |
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| Monoisotopic Molecular
Weight: |
126.0320046704 |
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| InChI Key: |
QQVDJLLNRSOCEL-UHFFFAOYSA-N |
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| InChI: |
InChI=1S/C2H8NO3P/c3-1-2-7(4,5)6/h1-3H2,(H2,4,5,6) |
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| CAS
number: |
2041-14-7 |
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| IUPAC Name: | hydrogen (2-azaniumylethyl)phosphonate |
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Traditional IUPAC Name: |
ciliatine |
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| SMILES: | C(CP([O-])(O)=O)[N+] |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of chemical entities known as organic phosphonic acids. These are organic compounds containing phosphonic acid. |
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Kingdom |
Chemical entities |
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| Super Class | Organic compounds |
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Class |
Organic acids and derivatives |
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| Sub Class | Organic phosphonic acids and derivatives |
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Direct Parent |
Organic phosphonic acids |
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| Alternative Parents |
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| Substituents |
- Organophosphonic acid
- Organic nitrogen compound
- Organic oxygen compound
- Organopnictogen compound
- Organic oxide
- Hydrocarbon derivative
- Primary amine
- Organophosphorus compound
- Organonitrogen compound
- Primary aliphatic amine
- Amine
- Aliphatic acyclic compound
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| Molecular Framework |
Aliphatic acyclic compounds |
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| External Descriptors |
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Physical Properties |
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| State: |
Solid |
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| Charge: | 0 |
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Melting point: |
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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Biological Properties |
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| Cellular Locations: |
Not Available |
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| Reactions: | |
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Pathways: |
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Spectra |
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| Spectra: |
Not Available |
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References |
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| References: |
Not Available |
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| Synthesis Reference: |
Not Available |
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| Material Safety Data Sheet (MSDS) |
Download (PDF) |
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Links |
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| External Links: |
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