(8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol

C14H22O — CID 11769666

IUPAC(8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol
SMILESCC/C=C\C/C=C\CCCC#CCCO
InChIInChI=1S/C14H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h3-4,6-7,15H,2,5,8-10,13-14H2,1H3/b4-3-,7-6-
InChIKeyRDYUCZPEPPWENX-CWWKMNTPSA-N
MW206.33 g/mol
LogP3.45
Rot. Bonds7

About (8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol

(8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol (PubChem CID 11769666) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is (8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol.

Molecular Properties

Compound Name(8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol
PubChem CID11769666
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Name(8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol
SMILESCC/C=C\C/C=C\CCCC#CCCO
InChIInChI=1S/C14H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h3-4,6-7,15H,2,5,8-10,13-14H2,1H3/b4-3-,7-6-
InChIKeyRDYUCZPEPPWENX-CWWKMNTPSA-N
XLogP3.45
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol?
The IUPAC name of (8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol (CID 11769666) is (8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol.
What is the SMILES notation for (8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol?
The canonical SMILES for (8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol is CC/C=C\C/C=C\CCCC#CCCO.
What is the InChIKey of (8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol?
The InChIKey is RDYUCZPEPPWENX-CWWKMNTPSA-N. The full InChI is InChI=1S/C14H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h3-4,6-7,15H,2,5,8-10,13-14H2,1H3/b4-3-,7-6-.
What are the key properties of (8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol?
(8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol has a molecular weight of 206.33 g/mol, XLogP of 3.45, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (8Z,11Z)-tetradeca-8,11-dien-3-yn-1-ol is sourced from PubChem (CID 11769666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).