cobalt;4,4-dimethylpent-2-ene

C7H13Co- — CID 140752146

IUPACcobalt;4,4-dimethylpent-2-ene
SMILES[CH2-]C=CC(C)(C)C.[Co]
InChIInChI=1S/C7H13.Co/c1-5-6-7(2,3)4;/h5-6H,1H2,2-4H3;/q-1;
InChIKeyHCFURLQTGZDJCN-UHFFFAOYSA-N
MW156.11 g/mol
LogP2.42
Rot. Bonds

About cobalt;4,4-dimethylpent-2-ene

cobalt;4,4-dimethylpent-2-ene (PubChem CID 140752146) has the molecular formula C7H13Co- and a molecular weight of 156.11 g/mol. Its IUPAC name is cobalt;4,4-dimethylpent-2-ene.

Molecular Properties

Compound Namecobalt;4,4-dimethylpent-2-ene
PubChem CID140752146
Molecular FormulaC7H13Co-
Molecular Weight156.11 g/mol
Exact Mass156.04
IUPAC Namecobalt;4,4-dimethylpent-2-ene
SMILES[CH2-]C=CC(C)(C)C.[Co]
InChIInChI=1S/C7H13.Co/c1-5-6-7(2,3)4;/h5-6H,1H2,2-4H3;/q-1;
InChIKeyHCFURLQTGZDJCN-UHFFFAOYSA-N
XLogP2.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.11
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze cobalt;4,4-dimethylpent-2-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of cobalt;4,4-dimethylpent-2-ene?
The IUPAC name of cobalt;4,4-dimethylpent-2-ene (CID 140752146) is cobalt;4,4-dimethylpent-2-ene.
What is the SMILES notation for cobalt;4,4-dimethylpent-2-ene?
The canonical SMILES for cobalt;4,4-dimethylpent-2-ene is [CH2-]C=CC(C)(C)C.[Co].
What is the InChIKey of cobalt;4,4-dimethylpent-2-ene?
The InChIKey is HCFURLQTGZDJCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13.Co/c1-5-6-7(2,3)4;/h5-6H,1H2,2-4H3;/q-1;.
What are the key properties of cobalt;4,4-dimethylpent-2-ene?
cobalt;4,4-dimethylpent-2-ene has a molecular weight of 156.11 g/mol, XLogP of 2.42, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;4,4-dimethylpent-2-ene is sourced from PubChem (CID 140752146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).