(3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol

C10H16O — CID 91748508

IUPAC(3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol
SMILESC=C/C(C)=C\C=C\C(C)(C)O
InChIInChI=1S/C10H16O/c1-5-9(2)7-6-8-10(3,4)11/h5-8,11H,1H2,2-4H3/b8-6+,9-7-
InChIKeyHYBLHNGOEIJQDA-FFELTBSMSA-N
MW152.24 g/mol
LogP2.45
Rot. Bonds3

About (3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol

(3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol (PubChem CID 91748508) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is (3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol.

Molecular Properties

Compound Name(3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol
PubChem CID91748508
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name(3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol
SMILESC=C/C(C)=C\C=C\C(C)(C)O
InChIInChI=1S/C10H16O/c1-5-9(2)7-6-8-10(3,4)11/h5-8,11H,1H2,2-4H3/b8-6+,9-7-
InChIKeyHYBLHNGOEIJQDA-FFELTBSMSA-N
XLogP2.45
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3,7-Dimethylocta-1,5,7-trien-3-ol
CID 5366264
Hotrienol
CID 40510009
(Z)-(1)-3,7-Dimethylocta-1,5,7-trien-3-ol
CID 85470793
3,7-Octadien-2-ol, 2-methyl-6-methylene-, (E)-
CID 5363351
1,5,7-Octatrien-3-ol, 3,7-dimethyl-
CID 103850
Yomogi alcohol
CID 5315406
3,7-Dimethyl-4,6-octadien-3-ol
CID 86750
(Z)-2-Methyloct-3-en-2-ol
CID 5366246
(3E)-2,4,8-Trimethylnona-3,7-dien-2-OL
CID 21972054
2,6,10-Trimethyldodeca-2,7(e),9(e),11-tetraen-6-ol
CID 11117576
trans-Ocimenol
CID 6430998
2,5-Dimethylhex-3-ene-2,5-diol
CID 5875483

Frequently Asked Questions

What is the IUPAC name of (3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol?
The IUPAC name of (3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol (CID 91748508) is (3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol.
What is the SMILES notation for (3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol?
The canonical SMILES for (3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol is C=C/C(C)=C\C=C\C(C)(C)O.
What is the InChIKey of (3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol?
The InChIKey is HYBLHNGOEIJQDA-FFELTBSMSA-N. The full InChI is InChI=1S/C10H16O/c1-5-9(2)7-6-8-10(3,4)11/h5-8,11H,1H2,2-4H3/b8-6+,9-7-.
What are the key properties of (3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol?
(3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol has a molecular weight of 152.24 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,5Z)-2,6-dimethylocta-3,5,7-trien-2-ol is sourced from PubChem (CID 91748508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).