5-ethyloctan-1-ol

C10H22O — CID 22492547

IUPAC5-ethyloctan-1-ol
SMILESCCCC(CC)CCCCO
InChIInChI=1S/C10H22O/c1-3-7-10(4-2)8-5-6-9-11/h10-11H,3-9H2,1-2H3
InChIKeyUQUKKYHIRMBILT-UHFFFAOYSA-N
MW158.28 g/mol
LogP2.98
Rot. Bonds7

About 5-ethyloctan-1-ol

5-ethyloctan-1-ol (PubChem CID 22492547) has the molecular formula C10H22O and a molecular weight of 158.28 g/mol. Its IUPAC name is 5-ethyloctan-1-ol.

Molecular Properties

Compound Name5-ethyloctan-1-ol
PubChem CID22492547
Molecular FormulaC10H22O
Molecular Weight158.28 g/mol
Exact Mass158.17
IUPAC Name5-ethyloctan-1-ol
SMILESCCCC(CC)CCCCO
InChIInChI=1S/C10H22O/c1-3-7-10(4-2)8-5-6-9-11/h10-11H,3-9H2,1-2H3
InChIKeyUQUKKYHIRMBILT-UHFFFAOYSA-N
XLogP2.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.28
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 5-ethyloctan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

18-ethylhenicosan-1-ol
CID 87097708
(3S)-3-ethyloctane-1,8-diol
CID 118889766
10-ethyldodecan-1-ol
CID 18475243
4-ethyldecan-1-ol
CID 91002231
8-ethyl-4-(2-hydroxyethyl)dodecane-1,12-diol
CID 170925289
4-ethyltridecan-1-ol
CID 20550506
(2S)-2-propylheptane-1,7-diol
CID 118890038
(3R)-3-ethylhexane-1,6-diol
CID 118889856
3-propyloctan-1-ol
CID 22492569
3,6-diethylnonane-1,9-diol
CID 19787583
4-ethylnonadecane
CID 22223766
4-ethylhexadecane
CID 528433

Frequently Asked Questions

What is the IUPAC name of 5-ethyloctan-1-ol?
The IUPAC name of 5-ethyloctan-1-ol (CID 22492547) is 5-ethyloctan-1-ol.
What is the SMILES notation for 5-ethyloctan-1-ol?
The canonical SMILES for 5-ethyloctan-1-ol is CCCC(CC)CCCCO.
What is the InChIKey of 5-ethyloctan-1-ol?
The InChIKey is UQUKKYHIRMBILT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O/c1-3-7-10(4-2)8-5-6-9-11/h10-11H,3-9H2,1-2H3.
What are the key properties of 5-ethyloctan-1-ol?
5-ethyloctan-1-ol has a molecular weight of 158.28 g/mol, XLogP of 2.98, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyloctan-1-ol is sourced from PubChem (CID 22492547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).