2,6-dimethylocta-4,5-dien-3-ol

C10H18O — CID 12555439

IUPAC2,6-dimethylocta-4,5-dien-3-ol
SMILESCCC(C)=C=CC(O)C(C)C
InChIInChI=1S/C10H18O/c1-5-9(4)6-7-10(11)8(2)3/h7-8,10-11H,5H2,1-4H3
InChIKeyUPVAQNRVYVEIIT-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.51
Rot. Bonds3

About 2,6-dimethylocta-4,5-dien-3-ol

2,6-dimethylocta-4,5-dien-3-ol (PubChem CID 12555439) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 2,6-dimethylocta-4,5-dien-3-ol.

Molecular Properties

Compound Name2,6-dimethylocta-4,5-dien-3-ol
PubChem CID12555439
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name2,6-dimethylocta-4,5-dien-3-ol
SMILESCCC(C)=C=CC(O)C(C)C
InChIInChI=1S/C10H18O/c1-5-9(4)6-7-10(11)8(2)3/h7-8,10-11H,5H2,1-4H3
InChIKeyUPVAQNRVYVEIIT-UHFFFAOYSA-N
XLogP2.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-Methyl-1-penten-3-ol
CID 20929
4-Hexen-3-ol, 2,5-dimethyl-
CID 558895
6-Methylhepta-2,3-dien-1-ol
CID 10396851
1,2-Heptadien-4-ol, 6-methyl-
CID 11615166
2-Methylhepta-2,3-dien-1-ol
CID 12507019
2-Methylocta-2,3-dien-1-ol
CID 15143004
2-Methylhexa-4,5-dien-3-ol
CID 10986182
5-Methyl-4-methylidenehexan-3-ol
CID 12036610
(3R)-4-methylpent-1-en-3-ol
CID 12477263
2,4-Dimethyl-4,5-hexadien-3-ol
CID 12651498
(3R)-2,5-dimethylhex-4-en-3-ol
CID 12783963
(3S)-4-methylpent-1-en-3-ol
CID 11083836

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylocta-4,5-dien-3-ol?
The IUPAC name of 2,6-dimethylocta-4,5-dien-3-ol (CID 12555439) is 2,6-dimethylocta-4,5-dien-3-ol.
What is the SMILES notation for 2,6-dimethylocta-4,5-dien-3-ol?
The canonical SMILES for 2,6-dimethylocta-4,5-dien-3-ol is CCC(C)=C=CC(O)C(C)C.
What is the InChIKey of 2,6-dimethylocta-4,5-dien-3-ol?
The InChIKey is UPVAQNRVYVEIIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-5-9(4)6-7-10(11)8(2)3/h7-8,10-11H,5H2,1-4H3.
What are the key properties of 2,6-dimethylocta-4,5-dien-3-ol?
2,6-dimethylocta-4,5-dien-3-ol has a molecular weight of 154.25 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylocta-4,5-dien-3-ol is sourced from PubChem (CID 12555439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).