(2R)-2-ethenyl-2,6,6-trimethyloxane

C10H18O — CID 6430803

IUPAC(2R)-2-ethenyl-2,6,6-trimethyloxane
SMILESC=C[C@@]1(C)CCCC(C)(C)O1
InChIInChI=1S/C10H18O/c1-5-10(4)8-6-7-9(2,3)11-10/h5H,1,6-8H2,2-4H3/t10-/m0/s1
InChIKeyNETOHYFTCONTDT-JTQLQIEISA-N
MW154.25 g/mol
LogP2.91
Rot. Bonds1

About (2R)-2-ethenyl-2,6,6-trimethyloxane

(2R)-2-ethenyl-2,6,6-trimethyloxane (PubChem CID 6430803) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (2R)-2-ethenyl-2,6,6-trimethyloxane.

Molecular Properties

Compound Name(2R)-2-ethenyl-2,6,6-trimethyloxane
PubChem CID6430803
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(2R)-2-ethenyl-2,6,6-trimethyloxane
SMILESC=C[C@@]1(C)CCCC(C)(C)O1
InChIInChI=1S/C10H18O/c1-5-10(4)8-6-7-9(2,3)11-10/h5H,1,6-8H2,2-4H3/t10-/m0/s1
InChIKeyNETOHYFTCONTDT-JTQLQIEISA-N
XLogP2.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.91
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-2,6,6-trimethyloxane?
The IUPAC name of (2R)-2-ethenyl-2,6,6-trimethyloxane (CID 6430803) is (2R)-2-ethenyl-2,6,6-trimethyloxane.
What is the SMILES notation for (2R)-2-ethenyl-2,6,6-trimethyloxane?
The canonical SMILES for (2R)-2-ethenyl-2,6,6-trimethyloxane is C=C[C@@]1(C)CCCC(C)(C)O1.
What is the InChIKey of (2R)-2-ethenyl-2,6,6-trimethyloxane?
The InChIKey is NETOHYFTCONTDT-JTQLQIEISA-N. The full InChI is InChI=1S/C10H18O/c1-5-10(4)8-6-7-9(2,3)11-10/h5H,1,6-8H2,2-4H3/t10-/m0/s1.
What are the key properties of (2R)-2-ethenyl-2,6,6-trimethyloxane?
(2R)-2-ethenyl-2,6,6-trimethyloxane has a molecular weight of 154.25 g/mol, XLogP of 2.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethenyl-2,6,6-trimethyloxane is sourced from PubChem (CID 6430803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).