(6E)-8-ethyl-2,6-dimethyldeca-2,6-diene

C14H26 — CID 174724877

IUPAC(6E)-8-ethyl-2,6-dimethyldeca-2,6-diene
SMILESCCC(/C=C(\C)CCC=C(C)C)CC
InChIInChI=1S/C14H26/c1-6-14(7-2)11-13(5)10-8-9-12(3)4/h9,11,14H,6-8,10H2,1-5H3/b13-11+
InChIKeyVRNCCQIVCSTAIB-ACCUITESSA-N
MW194.36 g/mol
LogP5.12
Rot. Bonds6

About (6E)-8-ethyl-2,6-dimethyldeca-2,6-diene

(6E)-8-ethyl-2,6-dimethyldeca-2,6-diene (PubChem CID 174724877) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is (6E)-8-ethyl-2,6-dimethyldeca-2,6-diene.

Molecular Properties

Compound Name(6E)-8-ethyl-2,6-dimethyldeca-2,6-diene
PubChem CID174724877
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name(6E)-8-ethyl-2,6-dimethyldeca-2,6-diene
SMILESCCC(/C=C(\C)CCC=C(C)C)CC
InChIInChI=1S/C14H26/c1-6-14(7-2)11-13(5)10-8-9-12(3)4/h9,11,14H,6-8,10H2,1-5H3/b13-11+
InChIKeyVRNCCQIVCSTAIB-ACCUITESSA-N
XLogP5.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500194.36
LogP ≤ 55.12
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 (6E)-8-ethyl-2,6-dimethyldeca-2,6-diene?
The IUPAC name of (6E)-8-ethyl-2,6-dimethyldeca-2,6-diene (CID 174724877) is (6E)-8-ethyl-2,6-dimethyldeca-2,6-diene.
What is the SMILES notation for (6E)-8-ethyl-2,6-dimethyldeca-2,6-diene?
The canonical SMILES for (6E)-8-ethyl-2,6-dimethyldeca-2,6-diene is CCC(/C=C(\C)CCC=C(C)C)CC.
What is the InChIKey of (6E)-8-ethyl-2,6-dimethyldeca-2,6-diene?
The InChIKey is VRNCCQIVCSTAIB-ACCUITESSA-N. The full InChI is InChI=1S/C14H26/c1-6-14(7-2)11-13(5)10-8-9-12(3)4/h9,11,14H,6-8,10H2,1-5H3/b13-11+.
What are the key properties of (6E)-8-ethyl-2,6-dimethyldeca-2,6-diene?
(6E)-8-ethyl-2,6-dimethyldeca-2,6-diene has a molecular weight of 194.36 g/mol, XLogP of 5.12, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6E)-8-ethyl-2,6-dimethyldeca-2,6-diene is sourced from PubChem (CID 174724877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).