(2E,6E,10E)-tricosa-2,6,10-trien-1-ol

C23H42O — CID 11461788

IUPAC(2E,6E,10E)-tricosa-2,6,10-trien-1-ol
SMILESCCCCCCCCCCCC/C=C/CC/C=C/CC/C=C/CO
InChIInChI=1S/C23H42O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24/h13-14,17-18,21-22,24H,2-12,15-16,19-20,23H2,1H3/b14-13+,18-17+,22-21+
InChIKeyWXQFUFDPQXQAEU-NSAANDJUSA-N
MW334.59 g/mol
LogP7.52
Rot. Bonds18

About (2E,6E,10E)-tricosa-2,6,10-trien-1-ol

(2E,6E,10E)-tricosa-2,6,10-trien-1-ol (PubChem CID 11461788) has the molecular formula C23H42O and a molecular weight of 334.59 g/mol. Its IUPAC name is (2E,6E,10E)-tricosa-2,6,10-trien-1-ol.

Molecular Properties

Compound Name(2E,6E,10E)-tricosa-2,6,10-trien-1-ol
PubChem CID11461788
Molecular FormulaC23H42O
Molecular Weight334.59 g/mol
Exact Mass334.32
IUPAC Name(2E,6E,10E)-tricosa-2,6,10-trien-1-ol
SMILESCCCCCCCCCCCC/C=C/CC/C=C/CC/C=C/CO
InChIInChI=1S/C23H42O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24/h13-14,17-18,21-22,24H,2-12,15-16,19-20,23H2,1H3/b14-13+,18-17+,22-21+
InChIKeyWXQFUFDPQXQAEU-NSAANDJUSA-N
XLogP7.52
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds18
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.59
LogP ≤ 57.52
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

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CID 10869774
(11Z)-icosa-2,11-dien-1-ol
CID 173009253
(E)-undec-2-en-1-ol
CID 5365004
(2E,13Z)-octadeca-2,13-dien-1-ol
CID 5283306
octadeca-2,13-dien-1-ol
CID 543270
acetic acid;(Z)-octadec-2-en-1-ol
CID 175144339
heptadeca-5,9-diene
CID 123203573
(5E,9E)-nonacosa-5,9-diene
CID 56936191
(Z)-tricos-11-ene
CID 5356790
(E)-nonacos-10-ene
CID 14367300
(E)-hexadec-6-ene
CID 5352260
(E)-hexacos-10-ene
CID 22172169

Frequently Asked Questions

What is the IUPAC name of (2E,6E,10E)-tricosa-2,6,10-trien-1-ol?
The IUPAC name of (2E,6E,10E)-tricosa-2,6,10-trien-1-ol (CID 11461788) is (2E,6E,10E)-tricosa-2,6,10-trien-1-ol.
What is the SMILES notation for (2E,6E,10E)-tricosa-2,6,10-trien-1-ol?
The canonical SMILES for (2E,6E,10E)-tricosa-2,6,10-trien-1-ol is CCCCCCCCCCCC/C=C/CC/C=C/CC/C=C/CO.
What is the InChIKey of (2E,6E,10E)-tricosa-2,6,10-trien-1-ol?
The InChIKey is WXQFUFDPQXQAEU-NSAANDJUSA-N. The full InChI is InChI=1S/C23H42O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24/h13-14,17-18,21-22,24H,2-12,15-16,19-20,23H2,1H3/b14-13+,18-17+,22-21+.
What are the key properties of (2E,6E,10E)-tricosa-2,6,10-trien-1-ol?
(2E,6E,10E)-tricosa-2,6,10-trien-1-ol has a molecular weight of 334.59 g/mol, XLogP of 7.52, 18 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,6E,10E)-tricosa-2,6,10-trien-1-ol is sourced from PubChem (CID 11461788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).