6-methoxy-2-methylnon-3-en-4-ol

C11H22O2 — CID 173120682

IUPAC6-methoxy-2-methylnon-3-en-4-ol
SMILESCCCC(CC(O)=CC(C)C)OC
InChIInChI=1S/C11H22O2/c1-5-6-11(13-4)8-10(12)7-9(2)3/h7,9,11-12H,5-6,8H2,1-4H3
InChIKeyUFXOLEOCNXINTL-UHFFFAOYSA-N
MW186.29 g/mol
LogP3.29
Rot. Bonds6

About 6-methoxy-2-methylnon-3-en-4-ol

6-methoxy-2-methylnon-3-en-4-ol (PubChem CID 173120682) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 6-methoxy-2-methylnon-3-en-4-ol.

Molecular Properties

Compound Name6-methoxy-2-methylnon-3-en-4-ol
PubChem CID173120682
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name6-methoxy-2-methylnon-3-en-4-ol
SMILESCCCC(CC(O)=CC(C)C)OC
InChIInChI=1S/C11H22O2/c1-5-6-11(13-4)8-10(12)7-9(2)3/h7,9,11-12H,5-6,8H2,1-4H3
InChIKeyUFXOLEOCNXINTL-UHFFFAOYSA-N
XLogP3.29
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

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1,2-dimethoxypentane
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(4S)-1-chloro-4-methoxyheptane
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1-chloro-4-methoxyheptane
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5-methoxy-2-methyloct-2-enal
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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-methylnon-3-en-4-ol?
The IUPAC name of 6-methoxy-2-methylnon-3-en-4-ol (CID 173120682) is 6-methoxy-2-methylnon-3-en-4-ol.
What is the SMILES notation for 6-methoxy-2-methylnon-3-en-4-ol?
The canonical SMILES for 6-methoxy-2-methylnon-3-en-4-ol is CCCC(CC(O)=CC(C)C)OC.
What is the InChIKey of 6-methoxy-2-methylnon-3-en-4-ol?
The InChIKey is UFXOLEOCNXINTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c1-5-6-11(13-4)8-10(12)7-9(2)3/h7,9,11-12H,5-6,8H2,1-4H3.
What are the key properties of 6-methoxy-2-methylnon-3-en-4-ol?
6-methoxy-2-methylnon-3-en-4-ol has a molecular weight of 186.29 g/mol, XLogP of 3.29, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-methylnon-3-en-4-ol is sourced from PubChem (CID 173120682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).