About sulfanium carbanide
sulfanium carbanide (PubChem CID 22633834) has the molecular formula CH6S
and a molecular weight of 50.13 g/mol. Its IUPAC name is sulfanium carbanide.
Molecular Properties
| Compound Name | sulfanium carbanide |
|---|
| PubChem CID | 22633834 |
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| Molecular Formula | CH6S |
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| Molecular Weight | 50.13 g/mol |
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| Exact Mass | 50.02 |
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| IUPAC Name | sulfanium carbanide |
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| SMILES | [CH3-].[SH3+] |
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| InChI | InChI=1S/CH3.H2S/h1H3;1H2/q-1;/p+1 |
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| InChIKey | XUHCUIVCWZKCJD-UHFFFAOYSA-O |
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| XLogP | -0.36 |
|---|
| TPSA | 0.00 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | |
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| Rotatable Bonds | |
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| Heavy Atoms | 2 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 50.13 |
| LogP ≤ 5 | -0.36 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of sulfanium carbanide?
The IUPAC name of sulfanium carbanide (CID 22633834) is sulfanium carbanide.
What is the SMILES notation for sulfanium carbanide?
The canonical SMILES for sulfanium carbanide is [CH3-].[SH3+].
What is the InChIKey of sulfanium carbanide?
The InChIKey is XUHCUIVCWZKCJD-UHFFFAOYSA-O. The full InChI is InChI=1S/CH3.H2S/h1H3;1H2/q-1;/p+1.
What are the key properties of sulfanium carbanide?
sulfanium carbanide has a molecular weight of 50.13 g/mol, XLogP of -0.36, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for sulfanium carbanide is sourced from PubChem (CID 22633834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).