About CID 134896189
CID 134896189 (PubChem CID 134896189) has the molecular formula C10H17ClMg
and a molecular weight of 197.00 g/mol.
Molecular Properties
| Compound Name | CID 134896189 |
|---|
| PubChem CID | 134896189 |
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| Molecular Formula | C10H17ClMg |
|---|
| Molecular Weight | 197.00 g/mol |
|---|
| Exact Mass | 196.09 |
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| IUPAC Name | — |
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| SMILES | CC1(C)[C@H]2C[CH-][C@]1(C)CC2.[Cl-].[Mg+2] |
|---|
| InChI | InChI=1S/C10H17.ClH.Mg/c1-9(2)8-4-6-10(9,3)7-5-8;;/h6,8H,4-5,7H2,1-3H3;1H;/q-1;;+2/p-1/t8-,10+;;/m0../s1 |
|---|
| InChIKey | CTBDMEVNKOXUKT-UQZKZZBYSA-M |
|---|
| XLogP | -0.34 |
|---|
| 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 | 12 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 197.00 |
| LogP ≤ 5 | -0.34 |
| 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 CID 134896189?
The IUPAC name of CID 134896189 (CID 134896189) is not available.
What is the SMILES notation for CID 134896189?
The canonical SMILES for CID 134896189 is CC1(C)[C@H]2C[CH-][C@]1(C)CC2.[Cl-].[Mg+2].
What is the InChIKey of CID 134896189?
The InChIKey is CTBDMEVNKOXUKT-UQZKZZBYSA-M. The full InChI is InChI=1S/C10H17.ClH.Mg/c1-9(2)8-4-6-10(9,3)7-5-8;;/h6,8H,4-5,7H2,1-3H3;1H;/q-1;;+2/p-1/t8-,10+;;/m0../s1.
What are the key properties of CID 134896189?
CID 134896189 has a molecular weight of 197.00 g/mol, XLogP of -0.34, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134896189 is sourced from PubChem (CID 134896189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).