(2R)-2-ethyl-2-methyloxane

C8H16O — CID 25420259

IUPAC(2R)-2-ethyl-2-methyloxane
SMILESCC[C@]1(C)CCCCO1
InChIInChI=1S/C8H16O/c1-3-8(2)6-4-5-7-9-8/h3-7H2,1-2H3/t8-/m1/s1
InChIKeyVVQDPBBEEQETOE-MRVPVSSYSA-N
MW128.22 g/mol
LogP2.36
Rot. Bonds1

About (2R)-2-ethyl-2-methyloxane

(2R)-2-ethyl-2-methyloxane (PubChem CID 25420259) has the molecular formula C8H16O and a molecular weight of 128.22 g/mol. Its IUPAC name is (2R)-2-ethyl-2-methyloxane.

Molecular Properties

Compound Name(2R)-2-ethyl-2-methyloxane
PubChem CID25420259
Molecular FormulaC8H16O
Molecular Weight128.22 g/mol
Exact Mass128.12
IUPAC Name(2R)-2-ethyl-2-methyloxane
SMILESCC[C@]1(C)CCCCO1
InChIInChI=1S/C8H16O/c1-3-8(2)6-4-5-7-9-8/h3-7H2,1-2H3/t8-/m1/s1
InChIKeyVVQDPBBEEQETOE-MRVPVSSYSA-N
XLogP2.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-isopropyl-2,6-diethyl-2-methyltetrahydro-2H-pyran
CID 45274957
2,2-Dimethyloxane
CID 12395962
Octane, 2-(or 6)-ethoxy-2,6-dimethyl-
CID 86129
Tetrahydro-2,2,6-trimethyl-2H-pyran
CID 122554
Cyclohexane, [(1,1-dimethylethoxy)methyl]-
CID 10877561
3-((1,1-Dimethylethoxy)methyl)heptane
CID 545858
2,2,6,6-Tetramethyloxane
CID 12593435
6-Oxaspiro[4,5]decane
CID 12630235
2,4,6-Trimethyltetrahydropyrane
CID 13776990
1-Oxaspiro[5.5]undecane
CID 15620796
2,6-Dimethyl-4-ethyltetrahydropyrane
CID 22965776
2-Methyl-3-propyltetrahydropyran
CID 57486098

Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethyl-2-methyloxane?
The IUPAC name of (2R)-2-ethyl-2-methyloxane (CID 25420259) is (2R)-2-ethyl-2-methyloxane.
What is the SMILES notation for (2R)-2-ethyl-2-methyloxane?
The canonical SMILES for (2R)-2-ethyl-2-methyloxane is CC[C@]1(C)CCCCO1.
What is the InChIKey of (2R)-2-ethyl-2-methyloxane?
The InChIKey is VVQDPBBEEQETOE-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H16O/c1-3-8(2)6-4-5-7-9-8/h3-7H2,1-2H3/t8-/m1/s1.
What are the key properties of (2R)-2-ethyl-2-methyloxane?
(2R)-2-ethyl-2-methyloxane has a molecular weight of 128.22 g/mol, XLogP of 2.36, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethyl-2-methyloxane is sourced from PubChem (CID 25420259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).