3-ethenyl-2-methoxy-2,3-dimethyloxane

C10H18O2 — CID 152595536

IUPAC3-ethenyl-2-methoxy-2,3-dimethyloxane
SMILESC=CC1(C)CCCOC1(C)OC
InChIInChI=1S/C10H18O2/c1-5-9(2)7-6-8-12-10(9,3)11-4/h5H,1,6-8H2,2-4H3
InChIKeyYWJYJMKMCPYKJE-UHFFFAOYSA-N
MW170.25 g/mol
LogP2.35
Rot. Bonds2

About 3-ethenyl-2-methoxy-2,3-dimethyloxane

3-ethenyl-2-methoxy-2,3-dimethyloxane (PubChem CID 152595536) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 3-ethenyl-2-methoxy-2,3-dimethyloxane.

Molecular Properties

Compound Name3-ethenyl-2-methoxy-2,3-dimethyloxane
PubChem CID152595536
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name3-ethenyl-2-methoxy-2,3-dimethyloxane
SMILESC=CC1(C)CCCOC1(C)OC
InChIInChI=1S/C10H18O2/c1-5-9(2)7-6-8-12-10(9,3)11-4/h5H,1,6-8H2,2-4H3
InChIKeyYWJYJMKMCPYKJE-UHFFFAOYSA-N
XLogP2.35
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-Methyl-4-prop-2-enyl-2,6-dioxabicyclo[2.2.2]octane
CID 86063451
(2R,6S)-2-methoxy-2-(2-methylbutan-2-yl)-6-prop-2-enyloxane
CID 89568453
3-But-1-enyl-2-(3-but-1-enyl-2,3-dimethyloxan-2-yl)oxy-2,3-dimethyloxane
CID 139629248
4,5-Bis(ethenyl)-2-methoxy-2,3,3,4-tetramethyloxane
CID 149917855
2-Ethenyl-2-methoxy-3-methyloxane
CID 159185549
2-(4-Methyl-4-prop-2-enylhept-6-enoxy)oxane
CID 170442125
2,2-Dimethyl-5-(oxiran-2-ylmethyl)-5-prop-2-enyl-1,3-dioxane
CID 11413206
(4S)-4-[(2S,3S)-2-methoxy-3-methylpent-4-enyl]-2,2,5,5-tetramethyl-1,3-dioxane
CID 53235916
5-But-3-enyl-2,2-dimethyl-5-prop-2-enyl-1,3-dioxane
CID 85855031

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-2-methoxy-2,3-dimethyloxane?
The IUPAC name of 3-ethenyl-2-methoxy-2,3-dimethyloxane (CID 152595536) is 3-ethenyl-2-methoxy-2,3-dimethyloxane.
What is the SMILES notation for 3-ethenyl-2-methoxy-2,3-dimethyloxane?
The canonical SMILES for 3-ethenyl-2-methoxy-2,3-dimethyloxane is C=CC1(C)CCCOC1(C)OC.
What is the InChIKey of 3-ethenyl-2-methoxy-2,3-dimethyloxane?
The InChIKey is YWJYJMKMCPYKJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-5-9(2)7-6-8-12-10(9,3)11-4/h5H,1,6-8H2,2-4H3.
What are the key properties of 3-ethenyl-2-methoxy-2,3-dimethyloxane?
3-ethenyl-2-methoxy-2,3-dimethyloxane has a molecular weight of 170.25 g/mol, XLogP of 2.35, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-2-methoxy-2,3-dimethyloxane is sourced from PubChem (CID 152595536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).