2,3-dimethylocta-2,6-dien-1-ol

C10H18O — CID 173476687

IUPAC2,3-dimethylocta-2,6-dien-1-ol
SMILESCC=CCCC(C)=C(C)CO
InChIInChI=1S/C10H18O/c1-4-5-6-7-9(2)10(3)8-11/h4-5,11H,6-8H2,1-3H3
InChIKeyIXGNOKSYBBAANF-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.67
Rot. Bonds4

About 2,3-dimethylocta-2,6-dien-1-ol

2,3-dimethylocta-2,6-dien-1-ol (PubChem CID 173476687) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 2,3-dimethylocta-2,6-dien-1-ol.

Molecular Properties

Compound Name2,3-dimethylocta-2,6-dien-1-ol
PubChem CID173476687
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name2,3-dimethylocta-2,6-dien-1-ol
SMILESCC=CCCC(C)=C(C)CO
InChIInChI=1S/C10H18O/c1-4-5-6-7-9(2)10(3)8-11/h4-5,11H,6-8H2,1-3H3
InChIKeyIXGNOKSYBBAANF-UHFFFAOYSA-N
XLogP2.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6,7-dimethyldeca-2,6-diene
CID 91199113
14,15,16-trimethylheptadeca-2,6,10,14-tetraene
CID 173098603
3-methylocta-2,6-dien-1-ol
CID 57183202
ethane;(5E)-2-methylhepta-1,5-diene
CID 143084582
3-methyldodeca-2,6,10-trien-1-ol
CID 57126192
(2Z,6E,10E,14E,18E,22Z)-6,10,15,19-tetramethyltetracosa-2,6,10,14,18,22-hexaene
CID 102073218
(2E,6E,10E,14E)-hexadeca-2,6,10,14-tetraen-1-ol
CID 21397771
(5Z)-hepta-1,5-dien-2-ol
CID 89297619
hexatriaconta-2,6,10,14,18,22,26,30,34-nonaene
CID 154144745
(2E,6Z,10E)-dodeca-2,6,10-triene
CID 12503721
(2E,6E,10E,14E,18E,22E)-tetracosa-2,6,10,14,18,22-hexaene
CID 57417215
octa-2,6-diene-1,2-diol
CID 174828973

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylocta-2,6-dien-1-ol?
The IUPAC name of 2,3-dimethylocta-2,6-dien-1-ol (CID 173476687) is 2,3-dimethylocta-2,6-dien-1-ol.
What is the SMILES notation for 2,3-dimethylocta-2,6-dien-1-ol?
The canonical SMILES for 2,3-dimethylocta-2,6-dien-1-ol is CC=CCCC(C)=C(C)CO.
What is the InChIKey of 2,3-dimethylocta-2,6-dien-1-ol?
The InChIKey is IXGNOKSYBBAANF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-4-5-6-7-9(2)10(3)8-11/h4-5,11H,6-8H2,1-3H3.
What are the key properties of 2,3-dimethylocta-2,6-dien-1-ol?
2,3-dimethylocta-2,6-dien-1-ol has a molecular weight of 154.25 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylocta-2,6-dien-1-ol is sourced from PubChem (CID 173476687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).