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

C10H18O — CID 145221921

IUPAC(1E,3E)-5-methylnona-1,3-dien-1-ol
SMILESCCCCC(C)/C=C/C=C/O
InChIInChI=1S/C10H18O/c1-3-4-7-10(2)8-5-6-9-11/h5-6,8-11H,3-4,7H2,1-2H3/b8-5+,9-6+
InChIKeyHCYBLCDEEGXUQM-XVYDYJIPSA-N
MW154.25 g/mol
LogP3.44
Rot. Bonds5

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

(1E,3E)-5-methylnona-1,3-dien-1-ol (PubChem CID 145221921) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (1E,3E)-5-methylnona-1,3-dien-1-ol.

Molecular Properties

Compound Name(1E,3E)-5-methylnona-1,3-dien-1-ol
PubChem CID145221921
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(1E,3E)-5-methylnona-1,3-dien-1-ol
SMILESCCCCC(C)/C=C/C=C/O
InChIInChI=1S/C10H18O/c1-3-4-7-10(2)8-5-6-9-11/h5-6,8-11H,3-4,7H2,1-2H3/b8-5+,9-6+
InChIKeyHCYBLCDEEGXUQM-XVYDYJIPSA-N
XLogP3.44
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
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 (1E,3E)-5-methylnona-1,3-dien-1-ol?
The IUPAC name of (1E,3E)-5-methylnona-1,3-dien-1-ol (CID 145221921) is (1E,3E)-5-methylnona-1,3-dien-1-ol.
What is the SMILES notation for (1E,3E)-5-methylnona-1,3-dien-1-ol?
The canonical SMILES for (1E,3E)-5-methylnona-1,3-dien-1-ol is CCCCC(C)/C=C/C=C/O.
What is the InChIKey of (1E,3E)-5-methylnona-1,3-dien-1-ol?
The InChIKey is HCYBLCDEEGXUQM-XVYDYJIPSA-N. The full InChI is InChI=1S/C10H18O/c1-3-4-7-10(2)8-5-6-9-11/h5-6,8-11H,3-4,7H2,1-2H3/b8-5+,9-6+.
What are the key properties of (1E,3E)-5-methylnona-1,3-dien-1-ol?
(1E,3E)-5-methylnona-1,3-dien-1-ol has a molecular weight of 154.25 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1E,3E)-5-methylnona-1,3-dien-1-ol is sourced from PubChem (CID 145221921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).