About (Z)-2,2-dimethyldodec-5-ene
(Z)-2,2-dimethyldodec-5-ene (PubChem CID 153455160) has the molecular formula C14H28
and a molecular weight of 196.38 g/mol. Its IUPAC name is (Z)-2,2-dimethyldodec-5-ene.
Molecular Properties
| Compound Name | (Z)-2,2-dimethyldodec-5-ene |
| PubChem CID | 153455160 |
| Molecular Formula | C14H28 |
| Molecular Weight | 196.38 g/mol |
| Exact Mass | 196.22 |
| IUPAC Name | (Z)-2,2-dimethyldodec-5-ene |
| SMILES | CCCCCC/C=C\CCC(C)(C)C |
| InChI | InChI=1S/C14H28/c1-5-6-7-8-9-10-11-12-13-14(2,3)4/h10-11H,5-9,12-13H2,1-4H3/b11-10- |
| InChIKey | ZXSIXENZLYJORH-KHPPLWFESA-N |
| XLogP | 5.34 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 7 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 196.38 |
| LogP ≤ 5 | 5.34 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (Z)-2,2-dimethyldodec-5-ene?
The IUPAC name of (Z)-2,2-dimethyldodec-5-ene (CID 153455160) is (Z)-2,2-dimethyldodec-5-ene.
What is the SMILES notation for (Z)-2,2-dimethyldodec-5-ene?
The canonical SMILES for (Z)-2,2-dimethyldodec-5-ene is CCCCCC/C=C\CCC(C)(C)C.
What is the InChIKey of (Z)-2,2-dimethyldodec-5-ene?
The InChIKey is ZXSIXENZLYJORH-KHPPLWFESA-N. The full InChI is InChI=1S/C14H28/c1-5-6-7-8-9-10-11-12-13-14(2,3)4/h10-11H,5-9,12-13H2,1-4H3/b11-10-.
What are the key properties of (Z)-2,2-dimethyldodec-5-ene?
(Z)-2,2-dimethyldodec-5-ene has a molecular weight of 196.38 g/mol, XLogP of 5.34, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2,2-dimethyldodec-5-ene is sourced from PubChem (CID 153455160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).