(4E)-3,7-dimethylocta-4,6-dien-1-ol

C10H18O — CID 15267831

IUPAC(4E)-3,7-dimethylocta-4,6-dien-1-ol
SMILESCC(C)=C/C=C/C(C)CCO
InChIInChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h4-6,10-11H,7-8H2,1-3H3/b6-4+
InChIKeyCXHLZAFYZWLCIN-GQCTYLIASA-N
MW154.25 g/mol
LogP2.53
Rot. Bonds4

About (4E)-3,7-dimethylocta-4,6-dien-1-ol

(4E)-3,7-dimethylocta-4,6-dien-1-ol (PubChem CID 15267831) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (4E)-3,7-dimethylocta-4,6-dien-1-ol.

Molecular Properties

Compound Name(4E)-3,7-dimethylocta-4,6-dien-1-ol
PubChem CID15267831
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(4E)-3,7-dimethylocta-4,6-dien-1-ol
SMILESCC(C)=C/C=C/C(C)CCO
InChIInChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h4-6,10-11H,7-8H2,1-3H3/b6-4+
InChIKeyCXHLZAFYZWLCIN-GQCTYLIASA-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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Related Compounds

(-)-Lavandulol
CID 5464156
Lavandulol, (+-)-
CID 94060
2,6-Dimethyl-5-hepten-1-ol
CID 240230
2,6,10-Trimethylundeca-5,9-dienol
CID 91116
5-Octen-1-ol, 6-ethyl-3-methyl-
CID 117305
(5E)-2,6,10-Trimethyl-5,9-undecadien-1-ol
CID 6364638
(Z)-Sesquilavandulol
CID 5352147
Lyratol
CID 5462982
2-Ethenyl-2,5-dimethylhex-4-en-1-ol
CID 549543
5,7-Dodecadien-1-ol
CID 5283274
(5Z,7E)-dodeca-5,7-dien-1-ol
CID 5365646
(5E,7Z)-5,7-Dodecadien-1-ol
CID 5365647

Frequently Asked Questions

What is the IUPAC name of (4E)-3,7-dimethylocta-4,6-dien-1-ol?
The IUPAC name of (4E)-3,7-dimethylocta-4,6-dien-1-ol (CID 15267831) is (4E)-3,7-dimethylocta-4,6-dien-1-ol.
What is the SMILES notation for (4E)-3,7-dimethylocta-4,6-dien-1-ol?
The canonical SMILES for (4E)-3,7-dimethylocta-4,6-dien-1-ol is CC(C)=C/C=C/C(C)CCO.
What is the InChIKey of (4E)-3,7-dimethylocta-4,6-dien-1-ol?
The InChIKey is CXHLZAFYZWLCIN-GQCTYLIASA-N. The full InChI is InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h4-6,10-11H,7-8H2,1-3H3/b6-4+.
What are the key properties of (4E)-3,7-dimethylocta-4,6-dien-1-ol?
(4E)-3,7-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)-3,7-dimethylocta-4,6-dien-1-ol is sourced from PubChem (CID 15267831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).