(5Z)-6-methylnona-5,8-dien-3-ol

C10H18O — CID 59545208

IUPAC(5Z)-6-methylnona-5,8-dien-3-ol
SMILESC=CC/C(C)=C\CC(O)CC
InChIInChI=1S/C10H18O/c1-4-6-9(3)7-8-10(11)5-2/h4,7,10-11H,1,5-6,8H2,2-3H3/b9-7-
InChIKeyITZXPEUBVGVZTB-CLFYSBASSA-N
MW154.25 g/mol
LogP2.67
Rot. Bonds5

About (5Z)-6-methylnona-5,8-dien-3-ol

(5Z)-6-methylnona-5,8-dien-3-ol (PubChem CID 59545208) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (5Z)-6-methylnona-5,8-dien-3-ol.

Molecular Properties

Compound Name(5Z)-6-methylnona-5,8-dien-3-ol
PubChem CID59545208
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(5Z)-6-methylnona-5,8-dien-3-ol
SMILESC=CC/C(C)=C\CC(O)CC
InChIInChI=1S/C10H18O/c1-4-6-9(3)7-8-10(11)5-2/h4,7,10-11H,1,5-6,8H2,2-3H3/b9-7-
InChIKeyITZXPEUBVGVZTB-CLFYSBASSA-N
XLogP2.67
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 ≤ 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 (5Z)-6-methylnona-5,8-dien-3-ol?
The IUPAC name of (5Z)-6-methylnona-5,8-dien-3-ol (CID 59545208) is (5Z)-6-methylnona-5,8-dien-3-ol.
What is the SMILES notation for (5Z)-6-methylnona-5,8-dien-3-ol?
The canonical SMILES for (5Z)-6-methylnona-5,8-dien-3-ol is C=CC/C(C)=C\CC(O)CC.
What is the InChIKey of (5Z)-6-methylnona-5,8-dien-3-ol?
The InChIKey is ITZXPEUBVGVZTB-CLFYSBASSA-N. The full InChI is InChI=1S/C10H18O/c1-4-6-9(3)7-8-10(11)5-2/h4,7,10-11H,1,5-6,8H2,2-3H3/b9-7-.
What are the key properties of (5Z)-6-methylnona-5,8-dien-3-ol?
(5Z)-6-methylnona-5,8-dien-3-ol has a molecular weight of 154.25 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-6-methylnona-5,8-dien-3-ol is sourced from PubChem (CID 59545208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).