8-cyclodecyl-8-hydroxyoctanoic acid

C18H34O3 — CID 150565467

IUPAC8-cyclodecyl-8-hydroxyoctanoic acid
SMILESO=C(O)CCCCCCC(O)C1CCCCCCCCC1
InChIInChI=1S/C18H34O3/c19-17(14-10-6-7-11-15-18(20)21)16-12-8-4-2-1-3-5-9-13-16/h16-17,19H,1-15H2,(H,20,21)
InChIKeyIKTAINYOKDQPEC-UHFFFAOYSA-N
MW298.47 g/mol
LogP4.91
Rot. Bonds8

About 8-cyclodecyl-8-hydroxyoctanoic acid

8-cyclodecyl-8-hydroxyoctanoic acid (PubChem CID 150565467) has the molecular formula C18H34O3 and a molecular weight of 298.47 g/mol. Its IUPAC name is 8-cyclodecyl-8-hydroxyoctanoic acid.

Molecular Properties

Compound Name8-cyclodecyl-8-hydroxyoctanoic acid
PubChem CID150565467
Molecular FormulaC18H34O3
Molecular Weight298.47 g/mol
Exact Mass298.25
IUPAC Name8-cyclodecyl-8-hydroxyoctanoic acid
SMILESO=C(O)CCCCCCC(O)C1CCCCCCCCC1
InChIInChI=1S/C18H34O3/c19-17(14-10-6-7-11-15-18(20)21)16-12-8-4-2-1-3-5-9-13-16/h16-17,19H,1-15H2,(H,20,21)
InChIKeyIKTAINYOKDQPEC-UHFFFAOYSA-N
XLogP4.91
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 54.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 8-cyclodecyl-8-hydroxyoctanoic acid?
The IUPAC name of 8-cyclodecyl-8-hydroxyoctanoic acid (CID 150565467) is 8-cyclodecyl-8-hydroxyoctanoic acid.
What is the SMILES notation for 8-cyclodecyl-8-hydroxyoctanoic acid?
The canonical SMILES for 8-cyclodecyl-8-hydroxyoctanoic acid is O=C(O)CCCCCCC(O)C1CCCCCCCCC1.
What is the InChIKey of 8-cyclodecyl-8-hydroxyoctanoic acid?
The InChIKey is IKTAINYOKDQPEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O3/c19-17(14-10-6-7-11-15-18(20)21)16-12-8-4-2-1-3-5-9-13-16/h16-17,19H,1-15H2,(H,20,21).
What are the key properties of 8-cyclodecyl-8-hydroxyoctanoic acid?
8-cyclodecyl-8-hydroxyoctanoic acid has a molecular weight of 298.47 g/mol, XLogP of 4.91, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclodecyl-8-hydroxyoctanoic acid is sourced from PubChem (CID 150565467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).