(2R)-2-ethyl-5-methyloxane

C8H16O — CID 146845250

IUPAC(2R)-2-ethyl-5-methyloxane
SMILESCC[C@@H]1CCC(C)CO1
InChIInChI=1S/C8H16O/c1-3-8-5-4-7(2)6-9-8/h7-8H,3-6H2,1-2H3/t7?,8-/m1/s1
InChIKeySGYCQTAGUGOJCU-BRFYHDHCSA-N
MW128.22 g/mol
LogP2.21
Rot. Bonds1

About (2R)-2-ethyl-5-methyloxane

(2R)-2-ethyl-5-methyloxane (PubChem CID 146845250) has the molecular formula C8H16O and a molecular weight of 128.22 g/mol. Its IUPAC name is (2R)-2-ethyl-5-methyloxane.

Molecular Properties

Compound Name(2R)-2-ethyl-5-methyloxane
PubChem CID146845250
Molecular FormulaC8H16O
Molecular Weight128.22 g/mol
Exact Mass128.12
IUPAC Name(2R)-2-ethyl-5-methyloxane
SMILESCC[C@@H]1CCC(C)CO1
InChIInChI=1S/C8H16O/c1-3-8-5-4-7(2)6-9-8/h7-8H,3-6H2,1-2H3/t7?,8-/m1/s1
InChIKeySGYCQTAGUGOJCU-BRFYHDHCSA-N
XLogP2.21
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 ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethyl-5-methyloxane?
The IUPAC name of (2R)-2-ethyl-5-methyloxane (CID 146845250) is (2R)-2-ethyl-5-methyloxane.
What is the SMILES notation for (2R)-2-ethyl-5-methyloxane?
The canonical SMILES for (2R)-2-ethyl-5-methyloxane is CC[C@@H]1CCC(C)CO1.
What is the InChIKey of (2R)-2-ethyl-5-methyloxane?
The InChIKey is SGYCQTAGUGOJCU-BRFYHDHCSA-N. The full InChI is InChI=1S/C8H16O/c1-3-8-5-4-7(2)6-9-8/h7-8H,3-6H2,1-2H3/t7?,8-/m1/s1.
What are the key properties of (2R)-2-ethyl-5-methyloxane?
(2R)-2-ethyl-5-methyloxane has a molecular weight of 128.22 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethyl-5-methyloxane is sourced from PubChem (CID 146845250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).