(6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene

C20H34 — CID 10401147

IUPAC(6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene
SMILESC=CC(C)(C/C=C(\C)CCC=C(C)C)CCC=C(C)C
InChIInChI=1S/C20H34/c1-8-20(7,15-10-12-18(4)5)16-14-19(6)13-9-11-17(2)3/h8,11-12,14H,1,9-10,13,15-16H2,2-7H3/b19-14+
InChIKeyMFGOTAHWOBKNNU-XMHGGMMESA-N
MW274.49 g/mol
LogP7.01
Rot. Bonds9

About (6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene

(6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene (PubChem CID 10401147) has the molecular formula C20H34 and a molecular weight of 274.49 g/mol. Its IUPAC name is (6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene.

Molecular Properties

Compound Name(6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene
PubChem CID10401147
Molecular FormulaC20H34
Molecular Weight274.49 g/mol
Exact Mass274.27
IUPAC Name(6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene
SMILESC=CC(C)(C/C=C(\C)CCC=C(C)C)CCC=C(C)C
InChIInChI=1S/C20H34/c1-8-20(7,15-10-12-18(4)5)16-14-19(6)13-9-11-17(2)3/h8,11-12,14H,1,9-10,13,15-16H2,2-7H3/b19-14+
InChIKeyMFGOTAHWOBKNNU-XMHGGMMESA-N
XLogP7.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.49
LogP ≤ 57.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene 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 (6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene?
The IUPAC name of (6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene (CID 10401147) is (6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene.
What is the SMILES notation for (6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene?
The canonical SMILES for (6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene is C=CC(C)(C/C=C(\C)CCC=C(C)C)CCC=C(C)C.
What is the InChIKey of (6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene?
The InChIKey is MFGOTAHWOBKNNU-XMHGGMMESA-N. The full InChI is InChI=1S/C20H34/c1-8-20(7,15-10-12-18(4)5)16-14-19(6)13-9-11-17(2)3/h8,11-12,14H,1,9-10,13,15-16H2,2-7H3/b19-14+.
What are the key properties of (6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene?
(6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene has a molecular weight of 274.49 g/mol, XLogP of 7.01, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6E)-9-ethenyl-2,6,9,13-tetramethyltetradeca-2,6,12-triene is sourced from PubChem (CID 10401147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).