About benzene;manganese;chloride
benzene;manganese;chloride (PubChem CID 175787776) has the molecular formula C24H20ClMn-5
and a molecular weight of 398.82 g/mol. Its IUPAC name is benzene;manganese;chloride.
Molecular Properties
| Compound Name | benzene;manganese;chloride |
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| PubChem CID | 175787776 |
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| Molecular Formula | C24H20ClMn-5 |
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| Molecular Weight | 398.82 g/mol |
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| Exact Mass | 398.07 |
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| IUPAC Name | benzene;manganese;chloride |
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| SMILES | [Cl-].[Mn].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1 |
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| InChI | InChI=1S/4C6H5.ClH.Mn/c4*1-2-4-6-5-3-1;;/h4*1-5H;1H;/q4*-1;;/p-1 |
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| InChIKey | DLZGPGYJVWMLLD-UHFFFAOYSA-M |
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| XLogP | 2.95 |
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| 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 | 26 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 398.82 |
| LogP ≤ 5 | 2.95 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of benzene;manganese;chloride?
The IUPAC name of benzene;manganese;chloride (CID 175787776) is benzene;manganese;chloride.
What is the SMILES notation for benzene;manganese;chloride?
The canonical SMILES for benzene;manganese;chloride is [Cl-].[Mn].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1.
What is the InChIKey of benzene;manganese;chloride?
The InChIKey is DLZGPGYJVWMLLD-UHFFFAOYSA-M. The full InChI is InChI=1S/4C6H5.ClH.Mn/c4*1-2-4-6-5-3-1;;/h4*1-5H;1H;/q4*-1;;/p-1.
What are the key properties of benzene;manganese;chloride?
benzene;manganese;chloride has a molecular weight of 398.82 g/mol, XLogP of 2.95, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;manganese;chloride is sourced from PubChem (CID 175787776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).