(5E)-3,5-dimethylocta-1,5-dien-3-ol

C10H18O — CID 134896877

IUPAC(5E)-3,5-dimethylocta-1,5-dien-3-ol
SMILESC=CC(C)(O)C/C(C)=C/CC
InChIInChI=1S/C10H18O/c1-5-7-9(3)8-10(4,11)6-2/h6-7,11H,2,5,8H2,1,3-4H3/b9-7+
InChIKeyVFMUZOUCZXDBHL-VQHVLOKHSA-N
MW154.25 g/mol
LogP2.67
Rot. Bonds4

About (5E)-3,5-dimethylocta-1,5-dien-3-ol

(5E)-3,5-dimethylocta-1,5-dien-3-ol (PubChem CID 134896877) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (5E)-3,5-dimethylocta-1,5-dien-3-ol.

Molecular Properties

Compound Name(5E)-3,5-dimethylocta-1,5-dien-3-ol
PubChem CID134896877
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(5E)-3,5-dimethylocta-1,5-dien-3-ol
SMILESC=CC(C)(O)C/C(C)=C/CC
InChIInChI=1S/C10H18O/c1-5-7-9(3)8-10(4,11)6-2/h6-7,11H,2,5,8H2,1,3-4H3/b9-7+
InChIKeyVFMUZOUCZXDBHL-VQHVLOKHSA-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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Frequently Asked Questions

What is the IUPAC name of (5E)-3,5-dimethylocta-1,5-dien-3-ol?
The IUPAC name of (5E)-3,5-dimethylocta-1,5-dien-3-ol (CID 134896877) is (5E)-3,5-dimethylocta-1,5-dien-3-ol.
What is the SMILES notation for (5E)-3,5-dimethylocta-1,5-dien-3-ol?
The canonical SMILES for (5E)-3,5-dimethylocta-1,5-dien-3-ol is C=CC(C)(O)C/C(C)=C/CC.
What is the InChIKey of (5E)-3,5-dimethylocta-1,5-dien-3-ol?
The InChIKey is VFMUZOUCZXDBHL-VQHVLOKHSA-N. The full InChI is InChI=1S/C10H18O/c1-5-7-9(3)8-10(4,11)6-2/h6-7,11H,2,5,8H2,1,3-4H3/b9-7+.
What are the key properties of (5E)-3,5-dimethylocta-1,5-dien-3-ol?
(5E)-3,5-dimethylocta-1,5-dien-3-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 (5E)-3,5-dimethylocta-1,5-dien-3-ol is sourced from PubChem (CID 134896877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).