(5E)-10-propyltrideca-5,9-dien-1-ol

C16H30O — CID 5283269

IUPAC(5E)-10-propyltrideca-5,9-dien-1-ol
SMILESCCCC(=CCC/C=C/CCCCO)CCC
InChIInChI=1S/C16H30O/c1-3-12-16(13-4-2)14-10-8-6-5-7-9-11-15-17/h5-6,14,17H,3-4,7-13,15H2,1-2H3/b6-5+
InChIKeyVFBQBIBMXSKCFS-AATRIKPKSA-N
MW238.41 g/mol
LogP5.01
Rot. Bonds11

About (5E)-10-propyltrideca-5,9-dien-1-ol

(5E)-10-propyltrideca-5,9-dien-1-ol (PubChem CID 5283269) has the molecular formula C16H30O and a molecular weight of 238.41 g/mol. Its IUPAC name is (5E)-10-propyltrideca-5,9-dien-1-ol.

Molecular Properties

Compound Name(5E)-10-propyltrideca-5,9-dien-1-ol
PubChem CID5283269
Molecular FormulaC16H30O
Molecular Weight238.41 g/mol
Exact Mass238.23
IUPAC Name(5E)-10-propyltrideca-5,9-dien-1-ol
SMILESCCCC(=CCC/C=C/CCCCO)CCC
InChIInChI=1S/C16H30O/c1-3-12-16(13-4-2)14-10-8-6-5-7-9-11-15-17/h5-6,14,17H,3-4,7-13,15H2,1-2H3/b6-5+
InChIKeyVFBQBIBMXSKCFS-AATRIKPKSA-N
XLogP5.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500238.41
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5E)-10-propyltrideca-5,9-dien-1-ol?
The IUPAC name of (5E)-10-propyltrideca-5,9-dien-1-ol (CID 5283269) is (5E)-10-propyltrideca-5,9-dien-1-ol.
What is the SMILES notation for (5E)-10-propyltrideca-5,9-dien-1-ol?
The canonical SMILES for (5E)-10-propyltrideca-5,9-dien-1-ol is CCCC(=CCC/C=C/CCCCO)CCC.
What is the InChIKey of (5E)-10-propyltrideca-5,9-dien-1-ol?
The InChIKey is VFBQBIBMXSKCFS-AATRIKPKSA-N. The full InChI is InChI=1S/C16H30O/c1-3-12-16(13-4-2)14-10-8-6-5-7-9-11-15-17/h5-6,14,17H,3-4,7-13,15H2,1-2H3/b6-5+.
What are the key properties of (5E)-10-propyltrideca-5,9-dien-1-ol?
(5E)-10-propyltrideca-5,9-dien-1-ol has a molecular weight of 238.41 g/mol, XLogP of 5.01, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-10-propyltrideca-5,9-dien-1-ol is sourced from PubChem (CID 5283269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).