2,6-dimethylocta-1,5,7-trien-1-ol

C10H16O — CID 176884331

IUPAC2,6-dimethylocta-1,5,7-trien-1-ol
SMILESC=CC(C)=CCCC(C)=CO
InChIInChI=1S/C10H16O/c1-4-9(2)6-5-7-10(3)8-11/h4,6,8,11H,1,5,7H2,2-3H3
InChIKeyDDBMOWGZUYLVTM-UHFFFAOYSA-N
MW152.24 g/mol
LogP3.36
Rot. Bonds4

About 2,6-dimethylocta-1,5,7-trien-1-ol

2,6-dimethylocta-1,5,7-trien-1-ol (PubChem CID 176884331) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 2,6-dimethylocta-1,5,7-trien-1-ol.

Molecular Properties

Compound Name2,6-dimethylocta-1,5,7-trien-1-ol
PubChem CID176884331
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name2,6-dimethylocta-1,5,7-trien-1-ol
SMILESC=CC(C)=CCCC(C)=CO
InChIInChI=1S/C10H16O/c1-4-9(2)6-5-7-10(3)8-11/h4,6,8,11H,1,5,7H2,2-3H3
InChIKeyDDBMOWGZUYLVTM-UHFFFAOYSA-N
XLogP3.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

(1E)-2,6-dimethylhepta-1,5-dien-1-ol
CID 12944525
(2Z,6E,9E)-2,6,10-trimethyldodeca-2,6,9,11-tetraenal
CID 118976608
(4Z,8E)-5,9-dimethylundeca-4,8,10-trienenitrile
CID 165348510
(3E,11Z)-3,12-dimethyltetradeca-1,3,11,13-tetraene
CID 142629908
(3E,6E,10E)-7-ethyl-3,11-dimethyltrideca-1,3,6,10-tetraene
CID 22236783
(6E)-2,2,3,7-tetramethylnona-6,8-dien-3-ol
CID 88710023
(1E)-2-methylocta-1,7-dien-1-ol
CID 88908688
(3E)-3-methylnona-1,3-diene
CID 13382655
(6E)-7,11-dimethyl-3-methylidenedodeca-1,6,10-triene;methane;(3E,6E)-3,7,11-trimethyldodeca-1,3,6,10-tetraene
CID 158402923
3-methylpenta-2,4-dien-1-ol
CID 534959
(3E)-7-methoxy-3,7-dimethylocta-1,3-diene
CID 88725055
(6E)-7-methylnona-6,8-dienoic acid
CID 14813173

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylocta-1,5,7-trien-1-ol?
The IUPAC name of 2,6-dimethylocta-1,5,7-trien-1-ol (CID 176884331) is 2,6-dimethylocta-1,5,7-trien-1-ol.
What is the SMILES notation for 2,6-dimethylocta-1,5,7-trien-1-ol?
The canonical SMILES for 2,6-dimethylocta-1,5,7-trien-1-ol is C=CC(C)=CCCC(C)=CO.
What is the InChIKey of 2,6-dimethylocta-1,5,7-trien-1-ol?
The InChIKey is DDBMOWGZUYLVTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-4-9(2)6-5-7-10(3)8-11/h4,6,8,11H,1,5,7H2,2-3H3.
What are the key properties of 2,6-dimethylocta-1,5,7-trien-1-ol?
2,6-dimethylocta-1,5,7-trien-1-ol has a molecular weight of 152.24 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylocta-1,5,7-trien-1-ol is sourced from PubChem (CID 176884331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).