icosa-5,8,11,14-tetraen-1-ol

C20H34O — CID 4282256

IUPACicosa-5,8,11,14-tetraen-1-ol
SMILESCCCCCC=CCC=CCC=CCC=CCCCCO
InChIInChI=1S/C20H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h6-7,9-10,12-13,15-16,21H,2-5,8,11,14,17-20H2,1H3
InChIKeyNYBCZSBDKXGAGM-UHFFFAOYSA-N
MW290.49 g/mol
LogP6.12
Rot. Bonds14

About icosa-5,8,11,14-tetraen-1-ol

icosa-5,8,11,14-tetraen-1-ol (PubChem CID 4282256) has the molecular formula C20H34O and a molecular weight of 290.49 g/mol. Its IUPAC name is icosa-5,8,11,14-tetraen-1-ol.

Molecular Properties

Compound Nameicosa-5,8,11,14-tetraen-1-ol
PubChem CID4282256
Molecular FormulaC20H34O
Molecular Weight290.49 g/mol
Exact Mass290.26
IUPAC Nameicosa-5,8,11,14-tetraen-1-ol
SMILESCCCCCC=CCC=CCC=CCC=CCCCCO
InChIInChI=1S/C20H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h6-7,9-10,12-13,15-16,21H,2-5,8,11,14,17-20H2,1H3
InChIKeyNYBCZSBDKXGAGM-UHFFFAOYSA-N
XLogP6.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.49
LogP ≤ 56.12
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'}

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Related Compounds

(11Z)-icosa-5,8,11,14-tetraen-1-ol
CID 175962679
(14Z)-icosa-5,8,11,14-tetraen-1-ol
CID 175206596
pentadeca-6,9-dien-1-ol
CID 548865
(7Z,10Z)-hexadeca-7,10-dien-1-ol
CID 129115258
(3Z,6Z,9Z)-pentadeca-3,6,9-trien-1-ol
CID 14359702
henicos-10-en-1-ol
CID 86069169
(Z)-octadec-7-en-1-ol
CID 13338918
(E)-heptadec-5-en-1-ol
CID 170849266
(E)-heptadec-7-en-1-ol
CID 19790013
(5Z,11Z)-icosa-5,11-dien-1-ol
CID 51353972
(E)-henicos-12-en-1-ol
CID 19702453
hexacos-17-en-1-ol
CID 139697197

Frequently Asked Questions

What is the IUPAC name of icosa-5,8,11,14-tetraen-1-ol?
The IUPAC name of icosa-5,8,11,14-tetraen-1-ol (CID 4282256) is icosa-5,8,11,14-tetraen-1-ol.
What is the SMILES notation for icosa-5,8,11,14-tetraen-1-ol?
The canonical SMILES for icosa-5,8,11,14-tetraen-1-ol is CCCCCC=CCC=CCC=CCC=CCCCCO.
What is the InChIKey of icosa-5,8,11,14-tetraen-1-ol?
The InChIKey is NYBCZSBDKXGAGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h6-7,9-10,12-13,15-16,21H,2-5,8,11,14,17-20H2,1H3.
What are the key properties of icosa-5,8,11,14-tetraen-1-ol?
icosa-5,8,11,14-tetraen-1-ol has a molecular weight of 290.49 g/mol, XLogP of 6.12, 14 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for icosa-5,8,11,14-tetraen-1-ol is sourced from PubChem (CID 4282256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).