About [(1R)-2-amino-1-hydroxyethyl]phosphonic acid
[(1R)-2-amino-1-hydroxyethyl]phosphonic acid (PubChem CID 10953606) has the molecular formula C2H8NO4P
and a molecular weight of 141.06 g/mol. Its IUPAC name is [(1R)-2-amino-1-hydroxyethyl]phosphonic acid.
Molecular Properties
| Compound Name | [(1R)-2-amino-1-hydroxyethyl]phosphonic acid |
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| PubChem CID | 10953606 |
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| Molecular Formula | C2H8NO4P |
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| Molecular Weight | 141.06 g/mol |
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| Exact Mass | 141.02 |
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| IUPAC Name | [(1R)-2-amino-1-hydroxyethyl]phosphonic acid |
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| SMILES | NC[C@H](O)P(=O)(O)O |
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| InChI | InChI=1S/C2H8NO4P/c3-1-2(4)8(5,6)7/h2,4H,1,3H2,(H2,5,6,7)/t2-/m1/s1 |
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| InChIKey | RTTXIBKRJFIBBG-UWTATZPHSA-N |
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| XLogP | -1.56 |
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| TPSA | 103.78 Ų |
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| H-Bond Donors | 4 |
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| H-Bond Acceptors | 3 |
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| Rotatable Bonds | 2 |
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| Heavy Atoms | 8 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
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| MW ≤ 500 | 141.06 |
| LogP ≤ 5 | -1.56 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [(1R)-2-amino-1-hydroxyethyl]phosphonic acid?
The IUPAC name of [(1R)-2-amino-1-hydroxyethyl]phosphonic acid (CID 10953606) is [(1R)-2-amino-1-hydroxyethyl]phosphonic acid.
What is the SMILES notation for [(1R)-2-amino-1-hydroxyethyl]phosphonic acid?
The canonical SMILES for [(1R)-2-amino-1-hydroxyethyl]phosphonic acid is NC[C@H](O)P(=O)(O)O.
What is the InChIKey of [(1R)-2-amino-1-hydroxyethyl]phosphonic acid?
The InChIKey is RTTXIBKRJFIBBG-UWTATZPHSA-N. The full InChI is InChI=1S/C2H8NO4P/c3-1-2(4)8(5,6)7/h2,4H,1,3H2,(H2,5,6,7)/t2-/m1/s1.
What are the key properties of [(1R)-2-amino-1-hydroxyethyl]phosphonic acid?
[(1R)-2-amino-1-hydroxyethyl]phosphonic acid has a molecular weight of 141.06 g/mol, XLogP of -1.56, 2 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-2-amino-1-hydroxyethyl]phosphonic acid is sourced from PubChem (CID 10953606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).