(2R)-2-ethenyl-2-methyl-3-methylideneoxolane

C8H12O — CID 163379901

IUPAC(2R)-2-ethenyl-2-methyl-3-methylideneoxolane
SMILESC=C[C@@]1(C)OCCC1=C
InChIInChI=1S/C8H12O/c1-4-8(3)7(2)5-6-9-8/h4H,1-2,5-6H2,3H3/t8-/m1/s1
InChIKeyOZBCFOIMLVTFSK-MRVPVSSYSA-N
MW124.18 g/mol
LogP1.91
Rot. Bonds1

About (2R)-2-ethenyl-2-methyl-3-methylideneoxolane

(2R)-2-ethenyl-2-methyl-3-methylideneoxolane (PubChem CID 163379901) has the molecular formula C8H12O and a molecular weight of 124.18 g/mol. Its IUPAC name is (2R)-2-ethenyl-2-methyl-3-methylideneoxolane.

Molecular Properties

Compound Name(2R)-2-ethenyl-2-methyl-3-methylideneoxolane
PubChem CID163379901
Molecular FormulaC8H12O
Molecular Weight124.18 g/mol
Exact Mass124.09
IUPAC Name(2R)-2-ethenyl-2-methyl-3-methylideneoxolane
SMILESC=C[C@@]1(C)OCCC1=C
InChIInChI=1S/C8H12O/c1-4-8(3)7(2)5-6-9-8/h4H,1-2,5-6H2,3H3/t8-/m1/s1
InChIKeyOZBCFOIMLVTFSK-MRVPVSSYSA-N
XLogP1.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.18
LogP ≤ 51.91
H-Bond Donors ≤ 50
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 (2R)-2-ethenyl-2-methyl-3-methylideneoxolane?
The IUPAC name of (2R)-2-ethenyl-2-methyl-3-methylideneoxolane (CID 163379901) is (2R)-2-ethenyl-2-methyl-3-methylideneoxolane.
What is the SMILES notation for (2R)-2-ethenyl-2-methyl-3-methylideneoxolane?
The canonical SMILES for (2R)-2-ethenyl-2-methyl-3-methylideneoxolane is C=C[C@@]1(C)OCCC1=C.
What is the InChIKey of (2R)-2-ethenyl-2-methyl-3-methylideneoxolane?
The InChIKey is OZBCFOIMLVTFSK-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H12O/c1-4-8(3)7(2)5-6-9-8/h4H,1-2,5-6H2,3H3/t8-/m1/s1.
What are the key properties of (2R)-2-ethenyl-2-methyl-3-methylideneoxolane?
(2R)-2-ethenyl-2-methyl-3-methylideneoxolane has a molecular weight of 124.18 g/mol, XLogP of 1.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethenyl-2-methyl-3-methylideneoxolane is sourced from PubChem (CID 163379901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).