undeca-1,3,5,7,9-pentayne

C11H4 — CID 22956829

IUPACundeca-1,3,5,7,9-pentayne
SMILESC#CC#CC#CC#CC#CC
InChIInChI=1S/C11H4/c1-3-5-7-9-11-10-8-6-4-2/h1H,2H3
InChIKeySKCKBJWLROGTOU-UHFFFAOYSA-N
MW136.15 g/mol
LogP0.65
Rot. Bonds

About undeca-1,3,5,7,9-pentayne

undeca-1,3,5,7,9-pentayne (PubChem CID 22956829) has the molecular formula C11H4 and a molecular weight of 136.15 g/mol. Its IUPAC name is undeca-1,3,5,7,9-pentayne.

Molecular Properties

Compound Nameundeca-1,3,5,7,9-pentayne
PubChem CID22956829
Molecular FormulaC11H4
Molecular Weight136.15 g/mol
Exact Mass136.03
IUPAC Nameundeca-1,3,5,7,9-pentayne
SMILESC#CC#CC#CC#CC#CC
InChIInChI=1S/C11H4/c1-3-5-7-9-11-10-8-6-4-2/h1H,2H3
InChIKeySKCKBJWLROGTOU-UHFFFAOYSA-N
XLogP0.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.15
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of undeca-1,3,5,7,9-pentayne?
The IUPAC name of undeca-1,3,5,7,9-pentayne (CID 22956829) is undeca-1,3,5,7,9-pentayne.
What is the SMILES notation for undeca-1,3,5,7,9-pentayne?
The canonical SMILES for undeca-1,3,5,7,9-pentayne is C#CC#CC#CC#CC#CC.
What is the InChIKey of undeca-1,3,5,7,9-pentayne?
The InChIKey is SKCKBJWLROGTOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H4/c1-3-5-7-9-11-10-8-6-4-2/h1H,2H3.
What are the key properties of undeca-1,3,5,7,9-pentayne?
undeca-1,3,5,7,9-pentayne has a molecular weight of 136.15 g/mol, XLogP of 0.65, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for undeca-1,3,5,7,9-pentayne is sourced from PubChem (CID 22956829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).