About hydroxylamine;dihydrate
hydroxylamine;dihydrate (PubChem CID 135863282) has the molecular formula H7NO3
and a molecular weight of 69.06 g/mol. Its IUPAC name is hydroxylamine;dihydrate.
Molecular Properties
| Compound Name | hydroxylamine;dihydrate |
|---|
| PubChem CID | 135863282 |
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| Molecular Formula | H7NO3 |
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| Molecular Weight | 69.06 g/mol |
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| Exact Mass | 69.04 |
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| IUPAC Name | hydroxylamine;dihydrate |
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| SMILES | NO.O.O |
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| InChI | InChI=1S/H3NO.2H2O/c1-2;;/h2H,1H2;2*1H2 |
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| InChIKey | YEVPNVHDUIZCME-UHFFFAOYSA-N |
|---|
| XLogP | -2.32 |
|---|
| TPSA | 109.25 Ų |
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| H-Bond Donors | 2 |
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| H-Bond Acceptors | 2 |
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| Rotatable Bonds | |
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| Heavy Atoms | 4 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 69.06 |
| LogP ≤ 5 | -2.32 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of hydroxylamine;dihydrate?
The IUPAC name of hydroxylamine;dihydrate (CID 135863282) is hydroxylamine;dihydrate.
What is the SMILES notation for hydroxylamine;dihydrate?
The canonical SMILES for hydroxylamine;dihydrate is NO.O.O.
What is the InChIKey of hydroxylamine;dihydrate?
The InChIKey is YEVPNVHDUIZCME-UHFFFAOYSA-N. The full InChI is InChI=1S/H3NO.2H2O/c1-2;;/h2H,1H2;2*1H2.
What are the key properties of hydroxylamine;dihydrate?
hydroxylamine;dihydrate has a molecular weight of 69.06 g/mol, XLogP of -2.32, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxylamine;dihydrate is sourced from PubChem (CID 135863282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).