(3E)-tetradeca-1,3-diene

C14H26 — CID 6365430

IUPAC(3E)-tetradeca-1,3-diene
SMILESC=C/C=C/CCCCCCCCCC
InChIInChI=1S/C14H26/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3,5,7H,1,4,6,8-14H2,2H3/b7-5+
InChIKeyLRIUTQPZISVIHK-FNORWQNLSA-N
MW194.36 g/mol
LogP5.26
Rot. Bonds10

About (3E)-tetradeca-1,3-diene

(3E)-tetradeca-1,3-diene (PubChem CID 6365430) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is (3E)-tetradeca-1,3-diene.

Molecular Properties

Compound Name(3E)-tetradeca-1,3-diene
PubChem CID6365430
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name(3E)-tetradeca-1,3-diene
SMILESC=C/C=C/CCCCCCCCCC
InChIInChI=1S/C14H26/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3,5,7H,1,4,6,8-14H2,2H3/b7-5+
InChIKeyLRIUTQPZISVIHK-FNORWQNLSA-N
XLogP5.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500194.36
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3E)-tetradeca-1,3-diene?
The IUPAC name of (3E)-tetradeca-1,3-diene (CID 6365430) is (3E)-tetradeca-1,3-diene.
What is the SMILES notation for (3E)-tetradeca-1,3-diene?
The canonical SMILES for (3E)-tetradeca-1,3-diene is C=C/C=C/CCCCCCCCCC.
What is the InChIKey of (3E)-tetradeca-1,3-diene?
The InChIKey is LRIUTQPZISVIHK-FNORWQNLSA-N. The full InChI is InChI=1S/C14H26/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3,5,7H,1,4,6,8-14H2,2H3/b7-5+.
What are the key properties of (3E)-tetradeca-1,3-diene?
(3E)-tetradeca-1,3-diene has a molecular weight of 194.36 g/mol, XLogP of 5.26, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-tetradeca-1,3-diene is sourced from PubChem (CID 6365430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).