5-methoxy-2,3-dimethyloct-2-en-1-ol

C11H22O2 — CID 91291967

IUPAC5-methoxy-2,3-dimethyloct-2-en-1-ol
SMILESCCCC(CC(C)=C(C)CO)OC
InChIInChI=1S/C11H22O2/c1-5-6-11(13-4)7-9(2)10(3)8-12/h11-12H,5-8H2,1-4H3
InChIKeyRMOLWMKHDLANJI-UHFFFAOYSA-N
MW186.29 g/mol
LogP2.52
Rot. Bonds6

About 5-methoxy-2,3-dimethyloct-2-en-1-ol

5-methoxy-2,3-dimethyloct-2-en-1-ol (PubChem CID 91291967) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 5-methoxy-2,3-dimethyloct-2-en-1-ol.

Molecular Properties

Compound Name5-methoxy-2,3-dimethyloct-2-en-1-ol
PubChem CID91291967
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name5-methoxy-2,3-dimethyloct-2-en-1-ol
SMILESCCCC(CC(C)=C(C)CO)OC
InChIInChI=1S/C11H22O2/c1-5-6-11(13-4)7-9(2)10(3)8-12/h11-12H,5-8H2,1-4H3
InChIKeyRMOLWMKHDLANJI-UHFFFAOYSA-N
XLogP2.52
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 ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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1,4-dimethoxyheptan-2-one
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6-methoxy-2-methylnon-3-en-4-ol
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5-methoxy-N-methyloctan-2-imine
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(E)-5-methoxy-3-methylnon-2-en-1-ol
CID 87272629
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CID 88754292
4-methoxyundecan-2-one
CID 14005013
4-methoxy-2-methylundec-1-ene
CID 162400851
2-[[(4R)-4-methoxyheptyl]amino]ethanol
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(4S)-1-chloro-4-methoxyheptane
CID 97035520

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2,3-dimethyloct-2-en-1-ol?
The IUPAC name of 5-methoxy-2,3-dimethyloct-2-en-1-ol (CID 91291967) is 5-methoxy-2,3-dimethyloct-2-en-1-ol.
What is the SMILES notation for 5-methoxy-2,3-dimethyloct-2-en-1-ol?
The canonical SMILES for 5-methoxy-2,3-dimethyloct-2-en-1-ol is CCCC(CC(C)=C(C)CO)OC.
What is the InChIKey of 5-methoxy-2,3-dimethyloct-2-en-1-ol?
The InChIKey is RMOLWMKHDLANJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c1-5-6-11(13-4)7-9(2)10(3)8-12/h11-12H,5-8H2,1-4H3.
What are the key properties of 5-methoxy-2,3-dimethyloct-2-en-1-ol?
5-methoxy-2,3-dimethyloct-2-en-1-ol has a molecular weight of 186.29 g/mol, XLogP of 2.52, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2,3-dimethyloct-2-en-1-ol is sourced from PubChem (CID 91291967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).