(4E)-2,7-dimethylocta-4,6-dien-1-ol

C10H18O — CID 14865537

IUPAC(4E)-2,7-dimethylocta-4,6-dien-1-ol
SMILESCC(C)=C/C=C/CC(C)CO
InChIInChI=1S/C10H18O/c1-9(2)6-4-5-7-10(3)8-11/h4-6,10-11H,7-8H2,1-3H3/b5-4+
InChIKeyVOPMCHBWEUCZJB-SNAWJCMRSA-N
MW154.25 g/mol
LogP2.53
Rot. Bonds4

About (4E)-2,7-dimethylocta-4,6-dien-1-ol

(4E)-2,7-dimethylocta-4,6-dien-1-ol (PubChem CID 14865537) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (4E)-2,7-dimethylocta-4,6-dien-1-ol.

Molecular Properties

Compound Name(4E)-2,7-dimethylocta-4,6-dien-1-ol
PubChem CID14865537
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(4E)-2,7-dimethylocta-4,6-dien-1-ol
SMILESCC(C)=C/C=C/CC(C)CO
InChIInChI=1S/C10H18O/c1-9(2)6-4-5-7-10(3)8-11/h4-6,10-11H,7-8H2,1-3H3/b5-4+
InChIKeyVOPMCHBWEUCZJB-SNAWJCMRSA-N
XLogP2.53
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 ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4E)-2,7-dimethylocta-4,6-dien-1-ol?
The IUPAC name of (4E)-2,7-dimethylocta-4,6-dien-1-ol (CID 14865537) is (4E)-2,7-dimethylocta-4,6-dien-1-ol.
What is the SMILES notation for (4E)-2,7-dimethylocta-4,6-dien-1-ol?
The canonical SMILES for (4E)-2,7-dimethylocta-4,6-dien-1-ol is CC(C)=C/C=C/CC(C)CO.
What is the InChIKey of (4E)-2,7-dimethylocta-4,6-dien-1-ol?
The InChIKey is VOPMCHBWEUCZJB-SNAWJCMRSA-N. The full InChI is InChI=1S/C10H18O/c1-9(2)6-4-5-7-10(3)8-11/h4-6,10-11H,7-8H2,1-3H3/b5-4+.
What are the key properties of (4E)-2,7-dimethylocta-4,6-dien-1-ol?
(4E)-2,7-dimethylocta-4,6-dien-1-ol has a molecular weight of 154.25 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-2,7-dimethylocta-4,6-dien-1-ol is sourced from PubChem (CID 14865537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).