(5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol

C14H22O — CID 101415351

IUPAC(5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol
SMILESCC/C=C/C=C/C=C/C=C/CCCCO
InChIInChI=1S/C14H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h3-10,15H,2,11-14H2,1H3/b4-3+,6-5+,8-7+,10-9+
InChIKeyBLTWGWDMUNKAIK-BYFNFPHLSA-N
MW206.33 g/mol
LogP3.78
Rot. Bonds8

About (5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol

(5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol (PubChem CID 101415351) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is (5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol.

Molecular Properties

Compound Name(5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol
PubChem CID101415351
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Name(5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol
SMILESCC/C=C/C=C/C=C/C=C/CCCCO
InChIInChI=1S/C14H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h3-10,15H,2,11-14H2,1H3/b4-3+,6-5+,8-7+,10-9+
InChIKeyBLTWGWDMUNKAIK-BYFNFPHLSA-N
XLogP3.78
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 (5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol?
The IUPAC name of (5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol (CID 101415351) is (5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol.
What is the SMILES notation for (5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol?
The canonical SMILES for (5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol is CC/C=C/C=C/C=C/C=C/CCCCO.
What is the InChIKey of (5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol?
The InChIKey is BLTWGWDMUNKAIK-BYFNFPHLSA-N. The full InChI is InChI=1S/C14H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h3-10,15H,2,11-14H2,1H3/b4-3+,6-5+,8-7+,10-9+.
What are the key properties of (5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol?
(5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol has a molecular weight of 206.33 g/mol, XLogP of 3.78, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5E,7E,9E,11E)-tetradeca-5,7,9,11-tetraen-1-ol is sourced from PubChem (CID 101415351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).