cyclododecylidenecyclododecane

C24H44 — CID 12600439

IUPACcyclododecylidenecyclododecane
SMILESC1CCCCCC(=C2CCCCCCCCCCC2)CCCCC1
InChIInChI=1S/C24H44/c1-3-7-11-15-19-23(20-16-12-8-4-1)24-21-17-13-9-5-2-6-10-14-18-22-24/h1-22H2
InChIKeyWRZSQZFOUWWQSM-UHFFFAOYSA-N
MW332.62 g/mol
LogP8.89
Rot. Bonds

About cyclododecylidenecyclododecane

cyclododecylidenecyclododecane (PubChem CID 12600439) has the molecular formula C24H44 and a molecular weight of 332.62 g/mol. Its IUPAC name is cyclododecylidenecyclododecane.

Molecular Properties

Compound Namecyclododecylidenecyclododecane
PubChem CID12600439
Molecular FormulaC24H44
Molecular Weight332.62 g/mol
Exact Mass332.34
IUPAC Namecyclododecylidenecyclododecane
SMILESC1CCCCCC(=C2CCCCCCCCCCC2)CCCCC1
InChIInChI=1S/C24H44/c1-3-7-11-15-19-23(20-16-12-8-4-1)24-21-17-13-9-5-2-6-10-14-18-22-24/h1-22H2
InChIKeyWRZSQZFOUWWQSM-UHFFFAOYSA-N
XLogP8.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.62
LogP ≤ 58.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclododecylidenecyclododecane?
The IUPAC name of cyclododecylidenecyclododecane (CID 12600439) is cyclododecylidenecyclododecane.
What is the SMILES notation for cyclododecylidenecyclododecane?
The canonical SMILES for cyclododecylidenecyclododecane is C1CCCCCC(=C2CCCCCCCCCCC2)CCCCC1.
What is the InChIKey of cyclododecylidenecyclododecane?
The InChIKey is WRZSQZFOUWWQSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H44/c1-3-7-11-15-19-23(20-16-12-8-4-1)24-21-17-13-9-5-2-6-10-14-18-22-24/h1-22H2.
What are the key properties of cyclododecylidenecyclododecane?
cyclododecylidenecyclododecane has a molecular weight of 332.62 g/mol, XLogP of 8.89, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclododecylidenecyclododecane is sourced from PubChem (CID 12600439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).