(2E,4E)-tetracosa-2,4-dienoic acid

C24H44O2 — CID 19784025

IUPAC(2E,4E)-tetracosa-2,4-dienoic acid
SMILESCCCCCCCCCCCCCCCCCCC/C=C/C=C/C(=O)O
InChIInChI=1S/C24H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h20-23H,2-19H2,1H3,(H,25,26)/b21-20+,23-22+
InChIKeyFAZMTGDKOVZNAB-RLJRJAJVSA-N
MW364.61 g/mol
LogP8.23
Rot. Bonds20

About (2E,4E)-tetracosa-2,4-dienoic acid

(2E,4E)-tetracosa-2,4-dienoic acid (PubChem CID 19784025) has the molecular formula C24H44O2 and a molecular weight of 364.61 g/mol. Its IUPAC name is (2E,4E)-tetracosa-2,4-dienoic acid.

Molecular Properties

Compound Name(2E,4E)-tetracosa-2,4-dienoic acid
PubChem CID19784025
Molecular FormulaC24H44O2
Molecular Weight364.61 g/mol
Exact Mass364.33
IUPAC Name(2E,4E)-tetracosa-2,4-dienoic acid
SMILESCCCCCCCCCCCCCCCCCCC/C=C/C=C/C(=O)O
InChIInChI=1S/C24H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h20-23H,2-19H2,1H3,(H,25,26)/b21-20+,23-22+
InChIKeyFAZMTGDKOVZNAB-RLJRJAJVSA-N
XLogP8.23
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds20
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.61
LogP ≤ 58.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2E,4E)-tetracosa-2,4-dienoic acid?
The IUPAC name of (2E,4E)-tetracosa-2,4-dienoic acid (CID 19784025) is (2E,4E)-tetracosa-2,4-dienoic acid.
What is the SMILES notation for (2E,4E)-tetracosa-2,4-dienoic acid?
The canonical SMILES for (2E,4E)-tetracosa-2,4-dienoic acid is CCCCCCCCCCCCCCCCCCC/C=C/C=C/C(=O)O.
What is the InChIKey of (2E,4E)-tetracosa-2,4-dienoic acid?
The InChIKey is FAZMTGDKOVZNAB-RLJRJAJVSA-N. The full InChI is InChI=1S/C24H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h20-23H,2-19H2,1H3,(H,25,26)/b21-20+,23-22+.
What are the key properties of (2E,4E)-tetracosa-2,4-dienoic acid?
(2E,4E)-tetracosa-2,4-dienoic acid has a molecular weight of 364.61 g/mol, XLogP of 8.23, 20 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E)-tetracosa-2,4-dienoic acid is sourced from PubChem (CID 19784025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).