(6Z)-nona-1,6-dien-3-ol

C9H16O — CID 20836173

IUPAC(6Z)-nona-1,6-dien-3-ol
SMILESC=CC(O)CC/C=C\CC
InChIInChI=1S/C9H16O/c1-3-5-6-7-8-9(10)4-2/h4-6,9-10H,2-3,7-8H2,1H3/b6-5-
InChIKeyLVQCRSHIONXSCD-WAYWQWQTSA-N
MW140.23 g/mol
LogP2.28
Rot. Bonds5

About (6Z)-nona-1,6-dien-3-ol

(6Z)-nona-1,6-dien-3-ol (PubChem CID 20836173) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is (6Z)-nona-1,6-dien-3-ol.

Molecular Properties

Compound Name(6Z)-nona-1,6-dien-3-ol
PubChem CID20836173
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name(6Z)-nona-1,6-dien-3-ol
SMILESC=CC(O)CC/C=C\CC
InChIInChI=1S/C9H16O/c1-3-5-6-7-8-9(10)4-2/h4-6,9-10H,2-3,7-8H2,1H3/b6-5-
InChIKeyLVQCRSHIONXSCD-WAYWQWQTSA-N
XLogP2.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.28
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 (6Z)-nona-1,6-dien-3-ol?
The IUPAC name of (6Z)-nona-1,6-dien-3-ol (CID 20836173) is (6Z)-nona-1,6-dien-3-ol.
What is the SMILES notation for (6Z)-nona-1,6-dien-3-ol?
The canonical SMILES for (6Z)-nona-1,6-dien-3-ol is C=CC(O)CC/C=C\CC.
What is the InChIKey of (6Z)-nona-1,6-dien-3-ol?
The InChIKey is LVQCRSHIONXSCD-WAYWQWQTSA-N. The full InChI is InChI=1S/C9H16O/c1-3-5-6-7-8-9(10)4-2/h4-6,9-10H,2-3,7-8H2,1H3/b6-5-.
What are the key properties of (6Z)-nona-1,6-dien-3-ol?
(6Z)-nona-1,6-dien-3-ol has a molecular weight of 140.23 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-nona-1,6-dien-3-ol is sourced from PubChem (CID 20836173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).