About 2-methylsulfonylnonan-3-ylhydrazine
2-methylsulfonylnonan-3-ylhydrazine (PubChem CID 105294018) has the molecular formula C10H24N2O2S
and a molecular weight of 236.38 g/mol. Its IUPAC name is 2-methylsulfonylnonan-3-ylhydrazine.
Molecular Properties
| Compound Name | 2-methylsulfonylnonan-3-ylhydrazine |
| PubChem CID | 105294018 |
| Molecular Formula | C10H24N2O2S |
| Molecular Weight | 236.38 g/mol |
| Exact Mass | 236.16 |
| IUPAC Name | 2-methylsulfonylnonan-3-ylhydrazine |
| SMILES | CCCCCCC(NN)C(C)S(C)(=O)=O |
| InChI | InChI=1S/C10H24N2O2S/c1-4-5-6-7-8-10(12-11)9(2)15(3,13)14/h9-10,12H,4-8,11H2,1-3H3 |
| InChIKey | LYMYZKOFTBGLTI-UHFFFAOYSA-N |
| XLogP | 1.22 |
| TPSA | 72.19 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 236.38 |
| LogP ≤ 5 | 1.22 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-methylsulfonylnonan-3-ylhydrazine?
The IUPAC name of 2-methylsulfonylnonan-3-ylhydrazine (CID 105294018) is 2-methylsulfonylnonan-3-ylhydrazine.
What is the SMILES notation for 2-methylsulfonylnonan-3-ylhydrazine?
The canonical SMILES for 2-methylsulfonylnonan-3-ylhydrazine is CCCCCCC(NN)C(C)S(C)(=O)=O.
What is the InChIKey of 2-methylsulfonylnonan-3-ylhydrazine?
The InChIKey is LYMYZKOFTBGLTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2S/c1-4-5-6-7-8-10(12-11)9(2)15(3,13)14/h9-10,12H,4-8,11H2,1-3H3.
What are the key properties of 2-methylsulfonylnonan-3-ylhydrazine?
2-methylsulfonylnonan-3-ylhydrazine has a molecular weight of 236.38 g/mol, XLogP of 1.22, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfonylnonan-3-ylhydrazine is sourced from PubChem (CID 105294018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).