(Z)-tetracos-15-enoic acid

C24H46O2 — CID 5281120

IUPAC(Z)-tetracos-15-enoic acid
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)O
InChIInChI=1S/C24H46O2/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/h9-10H,2-8,11-23H2,1H3,(H,25,26)/b10-9-
InChIKeyGWHCXVQVJPWHRF-KTKRTIGZSA-N
MW366.63 g/mol
LogP8.45
Rot. Bonds21

About (Z)-tetracos-15-enoic acid

(Z)-tetracos-15-enoic acid (PubChem CID 5281120) has the molecular formula C24H46O2 and a molecular weight of 366.63 g/mol. Its IUPAC name is (Z)-tetracos-15-enoic acid.

Molecular Properties

Compound Name(Z)-tetracos-15-enoic acid
PubChem CID5281120
Molecular FormulaC24H46O2
Molecular Weight366.63 g/mol
Exact Mass366.35
IUPAC Name(Z)-tetracos-15-enoic acid
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)O
InChIInChI=1S/C24H46O2/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/h9-10H,2-8,11-23H2,1H3,(H,25,26)/b10-9-
InChIKeyGWHCXVQVJPWHRF-KTKRTIGZSA-N
XLogP8.45
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds21
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.63
LogP ≤ 58.45
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'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-tetracos-15-enoic acid?
The IUPAC name of (Z)-tetracos-15-enoic acid (CID 5281120) is (Z)-tetracos-15-enoic acid.
What is the SMILES notation for (Z)-tetracos-15-enoic acid?
The canonical SMILES for (Z)-tetracos-15-enoic acid is CCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)O.
What is the InChIKey of (Z)-tetracos-15-enoic acid?
The InChIKey is GWHCXVQVJPWHRF-KTKRTIGZSA-N. The full InChI is InChI=1S/C24H46O2/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/h9-10H,2-8,11-23H2,1H3,(H,25,26)/b10-9-.
What are the key properties of (Z)-tetracos-15-enoic acid?
(Z)-tetracos-15-enoic acid has a molecular weight of 366.63 g/mol, XLogP of 8.45, 21 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-tetracos-15-enoic acid is sourced from PubChem (CID 5281120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).