(2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal

C11H14O — CID 6440321

IUPAC(2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal
SMILESCC/C=C/C=C/C=C/C=C/C=O
InChIInChI=1S/C11H14O/c1-2-3-4-5-6-7-8-9-10-11-12/h3-11H,2H2,1H3/b4-3+,6-5+,8-7+,10-9+
InChIKeyWUGCJUPOLHRZFG-BYFNFPHLSA-N
MW162.23 g/mol
LogP2.82
Rot. Bonds5

About (2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal

(2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal (PubChem CID 6440321) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is (2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal.

Molecular Properties

Compound Name(2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal
PubChem CID6440321
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name(2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal
SMILESCC/C=C/C=C/C=C/C=C/C=O
InChIInChI=1S/C11H14O/c1-2-3-4-5-6-7-8-9-10-11-12/h3-11H,2H2,1H3/b4-3+,6-5+,8-7+,10-9+
InChIKeyWUGCJUPOLHRZFG-BYFNFPHLSA-N
XLogP2.82
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal?
The IUPAC name of (2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal (CID 6440321) is (2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal.
What is the SMILES notation for (2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal?
The canonical SMILES for (2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal is CC/C=C/C=C/C=C/C=C/C=O.
What is the InChIKey of (2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal?
The InChIKey is WUGCJUPOLHRZFG-BYFNFPHLSA-N. The full InChI is InChI=1S/C11H14O/c1-2-3-4-5-6-7-8-9-10-11-12/h3-11H,2H2,1H3/b4-3+,6-5+,8-7+,10-9+.
What are the key properties of (2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal?
(2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal has a molecular weight of 162.23 g/mol, XLogP of 2.82, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E,6E,8E)-undeca-2,4,6,8-tetraenal is sourced from PubChem (CID 6440321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).