(7E,11Z)-cyclotetradeca-1,3,7,11-tetraene

C14H20 — CID 173030521

IUPAC(7E,11Z)-cyclotetradeca-1,3,7,11-tetraene
SMILESC1=CCC/C=C\CC/C=C/CCC=C1
InChIInChI=1S/C14H20/c1-2-4-6-8-10-12-14-13-11-9-7-5-3-1/h1-4,9-12H,5-8,13-14H2/b3-1?,4-2?,11-9-,12-10+
InChIKeyQWHBSYPTDQUVDY-CALZCFAKSA-N
MW188.31 g/mol
LogP4.57
Rot. Bonds

About (7E,11Z)-cyclotetradeca-1,3,7,11-tetraene

(7E,11Z)-cyclotetradeca-1,3,7,11-tetraene (PubChem CID 173030521) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is (7E,11Z)-cyclotetradeca-1,3,7,11-tetraene.

Molecular Properties

Compound Name(7E,11Z)-cyclotetradeca-1,3,7,11-tetraene
PubChem CID173030521
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Name(7E,11Z)-cyclotetradeca-1,3,7,11-tetraene
SMILESC1=CCC/C=C\CC/C=C/CCC=C1
InChIInChI=1S/C14H20/c1-2-4-6-8-10-12-14-13-11-9-7-5-3-1/h1-4,9-12H,5-8,13-14H2/b3-1?,4-2?,11-9-,12-10+
InChIKeyQWHBSYPTDQUVDY-CALZCFAKSA-N
XLogP4.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 54.57
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 (7E,11Z)-cyclotetradeca-1,3,7,11-tetraene?
The IUPAC name of (7E,11Z)-cyclotetradeca-1,3,7,11-tetraene (CID 173030521) is (7E,11Z)-cyclotetradeca-1,3,7,11-tetraene.
What is the SMILES notation for (7E,11Z)-cyclotetradeca-1,3,7,11-tetraene?
The canonical SMILES for (7E,11Z)-cyclotetradeca-1,3,7,11-tetraene is C1=CCC/C=C\CC/C=C/CCC=C1.
What is the InChIKey of (7E,11Z)-cyclotetradeca-1,3,7,11-tetraene?
The InChIKey is QWHBSYPTDQUVDY-CALZCFAKSA-N. The full InChI is InChI=1S/C14H20/c1-2-4-6-8-10-12-14-13-11-9-7-5-3-1/h1-4,9-12H,5-8,13-14H2/b3-1?,4-2?,11-9-,12-10+.
What are the key properties of (7E,11Z)-cyclotetradeca-1,3,7,11-tetraene?
(7E,11Z)-cyclotetradeca-1,3,7,11-tetraene has a molecular weight of 188.31 g/mol, XLogP of 4.57, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (7E,11Z)-cyclotetradeca-1,3,7,11-tetraene is sourced from PubChem (CID 173030521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).