| Sonrisas canónicas | CC1C(O1)P(=O)(O)O.C(C(CO)(CO)N)O |
|---|---|
| IUPAC Name | 2-amino-2-(hydroxymethyl)propane-1,3-diol;[(2R,3S)-3-methyloxiran-2-yl]phosphonic acid |
| InChIKey | QZJIMDIBFFHQDW-LMLSDSMGSA-N |
| INCHI | 1S/C4H11NO3.C3H7O4P/c5-4(1-6,2-7)3-8;1-2-3(7-2)8(4,5)6/h6-8H,1-3,5H2;2-3H,1H3,(H2,4,5,6)/t;2-,3+/m.0/s1 |
| Isómeros SMILES | C[C@H]1[C@H](O1)P(=O)(O)O.C(C(CO)(CO)N)O |
| PubChem CID | 10199068 |
| Peso molecular | 259.2 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic acids and derivatives |
| Clase | Organic phosphonic acids and derivatives |
| Subclass | Organic phosphonic acids |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Organic phosphonic acids |
| Alternative Parents | 1,2-aminoalcohols Oxacyclic compounds Epoxides Primary alcohols Organopnictogen compounds Organophosphorus compounds Organic salts Organic oxides Monoalkylamines Hydrocarbon derivatives |
| Molecular Framework | Not available |
| Substituents | Organophosphonic acid - 1,2-aminoalcohol - Oxirane - Organoheterocyclic compound - Oxacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic salt - Primary amine - Primary alcohol - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Primary aliphatic amine - Organic oxygen compound - Amine - Alcohol - Aliphatic heteromonocyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as organic phosphonic acids. These are organic compounds containing phosphonic acid. |
| External Descriptors | Not available |
| Punto de fusión (°C) | 123-127° C |
|---|---|
| Peso molecular | 259.190 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 4 |
| Exact Mass | 259.082 Da |
| Monoisotopic Mass | 259.082 Da |
| Topological Polar Surface Area | 157.000 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 192.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 2 |
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