2-ethyloct-2-en-1-ol

C10H20O — CID 54080127

IUPAC2-ethyloct-2-en-1-ol
SMILESCCCCCC=C(CC)CO
InChIInChI=1S/C10H20O/c1-3-5-6-7-8-10(4-2)9-11/h8,11H,3-7,9H2,1-2H3
InChIKeyVJFWPWWIXQOVLG-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.90
Rot. Bonds6

About 2-ethyloct-2-en-1-ol

2-ethyloct-2-en-1-ol (PubChem CID 54080127) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-ethyloct-2-en-1-ol.

Molecular Properties

Compound Name2-ethyloct-2-en-1-ol
PubChem CID54080127
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name2-ethyloct-2-en-1-ol
SMILESCCCCCC=C(CC)CO
InChIInChI=1S/C10H20O/c1-3-5-6-7-8-10(4-2)9-11/h8,11H,3-7,9H2,1-2H3
InChIKeyVJFWPWWIXQOVLG-UHFFFAOYSA-N
XLogP2.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.90
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

(Z)-2-ethyldec-2-en-1-ol
CID 13479207
(E)-2-pentylnon-2-en-1-ol
CID 87912407
6-ethyltridec-6-ene
CID 123238287
5-ethyltetradec-5-ene
CID 54129215
(Z)-7-ethyltetradec-7-ene
CID 134978641
(Z)-6-ethylundec-5-ene
CID 102395453
2-ethylicosa-2,11,14,17-tetraen-1-ol
CID 74388131
(E)-5-ethyldec-4-ene
CID 173194379
(E)-3-methylnon-3-ene
CID 5364647
(E)-6-butylpentadec-6-en-1-ol
CID 10265818
5-ethyldodec-4-ene
CID 123814834
[(E)-2-ethylnon-2-enyl] acetate
CID 88547353

Frequently Asked Questions

What is the IUPAC name of 2-ethyloct-2-en-1-ol?
The IUPAC name of 2-ethyloct-2-en-1-ol (CID 54080127) is 2-ethyloct-2-en-1-ol.
What is the SMILES notation for 2-ethyloct-2-en-1-ol?
The canonical SMILES for 2-ethyloct-2-en-1-ol is CCCCCC=C(CC)CO.
What is the InChIKey of 2-ethyloct-2-en-1-ol?
The InChIKey is VJFWPWWIXQOVLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-3-5-6-7-8-10(4-2)9-11/h8,11H,3-7,9H2,1-2H3.
What are the key properties of 2-ethyloct-2-en-1-ol?
2-ethyloct-2-en-1-ol has a molecular weight of 156.27 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyloct-2-en-1-ol is sourced from PubChem (CID 54080127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).