deca-1,7-dien-4-ol

C10H18O — CID 71368802

IUPACdeca-1,7-dien-4-ol
SMILESC=CCC(O)CCC=CCC
InChIInChI=1S/C10H18O/c1-3-5-6-7-9-10(11)8-4-2/h4-6,10-11H,2-3,7-9H2,1H3
InChIKeyRUANIJKRDSEAQM-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.67
Rot. Bonds6

About deca-1,7-dien-4-ol

deca-1,7-dien-4-ol (PubChem CID 71368802) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is deca-1,7-dien-4-ol.

Molecular Properties

Compound Namedeca-1,7-dien-4-ol
PubChem CID71368802
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Namedeca-1,7-dien-4-ol
SMILESC=CCC(O)CCC=CCC
InChIInChI=1S/C10H18O/c1-3-5-6-7-9-10(11)8-4-2/h4-6,10-11H,2-3,7-9H2,1H3
InChIKeyRUANIJKRDSEAQM-UHFFFAOYSA-N
XLogP2.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of deca-1,7-dien-4-ol?
The IUPAC name of deca-1,7-dien-4-ol (CID 71368802) is deca-1,7-dien-4-ol.
What is the SMILES notation for deca-1,7-dien-4-ol?
The canonical SMILES for deca-1,7-dien-4-ol is C=CCC(O)CCC=CCC.
What is the InChIKey of deca-1,7-dien-4-ol?
The InChIKey is RUANIJKRDSEAQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-3-5-6-7-9-10(11)8-4-2/h4-6,10-11H,2-3,7-9H2,1H3.
What are the key properties of deca-1,7-dien-4-ol?
deca-1,7-dien-4-ol has a molecular weight of 154.25 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for deca-1,7-dien-4-ol is sourced from PubChem (CID 71368802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).