(1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol

C10H18O — CID 141062858

IUPAC(1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol
SMILESCC(/C=C\O)=C\CCC(C)C
InChIInChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h6-9,11H,4-5H2,1-3H3/b8-7-,10-6+
InChIKeyZZORNGYUXDHDIL-SDHBEMGISA-N
MW154.25 g/mol
LogP3.44
Rot. Bonds4

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

(1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol (PubChem CID 141062858) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol.

Molecular Properties

Compound Name(1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol
PubChem CID141062858
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol
SMILESCC(/C=C\O)=C\CCC(C)C
InChIInChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h6-9,11H,4-5H2,1-3H3/b8-7-,10-6+
InChIKeyZZORNGYUXDHDIL-SDHBEMGISA-N
XLogP3.44
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 ≤ 53.44
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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Frequently Asked Questions

What is the IUPAC name of (1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol?
The IUPAC name of (1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol (CID 141062858) is (1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol.
What is the SMILES notation for (1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol?
The canonical SMILES for (1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol is CC(/C=C\O)=C\CCC(C)C.
What is the InChIKey of (1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol?
The InChIKey is ZZORNGYUXDHDIL-SDHBEMGISA-N. The full InChI is InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h6-9,11H,4-5H2,1-3H3/b8-7-,10-6+.
What are the key properties of (1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol?
(1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol has a molecular weight of 154.25 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3E)-3,7-dimethylocta-1,3-dien-1-ol is sourced from PubChem (CID 141062858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).