(2S)-2-(2-methoxyethyl)oxane

C8H16O2 — CID 58166172

IUPAC(2S)-2-(2-methoxyethyl)oxane
SMILESCOCC[C@@H]1CCCCO1
InChIInChI=1S/C8H16O2/c1-9-7-5-8-4-2-3-6-10-8/h8H,2-7H2,1H3/t8-/m0/s1
InChIKeyOPIRTWMWEWQOJJ-QMMMGPOBSA-N
MW144.21 g/mol
LogP1.59
Rot. Bonds3

About (2S)-2-(2-methoxyethyl)oxane

(2S)-2-(2-methoxyethyl)oxane (PubChem CID 58166172) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is (2S)-2-(2-methoxyethyl)oxane.

Molecular Properties

Compound Name(2S)-2-(2-methoxyethyl)oxane
PubChem CID58166172
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name(2S)-2-(2-methoxyethyl)oxane
SMILESCOCC[C@@H]1CCCCO1
InChIInChI=1S/C8H16O2/c1-9-7-5-8-4-2-3-6-10-8/h8H,2-7H2,1H3/t8-/m0/s1
InChIKeyOPIRTWMWEWQOJJ-QMMMGPOBSA-N
XLogP1.59
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2-methoxyethyl)oxane?
The IUPAC name of (2S)-2-(2-methoxyethyl)oxane (CID 58166172) is (2S)-2-(2-methoxyethyl)oxane.
What is the SMILES notation for (2S)-2-(2-methoxyethyl)oxane?
The canonical SMILES for (2S)-2-(2-methoxyethyl)oxane is COCC[C@@H]1CCCCO1.
What is the InChIKey of (2S)-2-(2-methoxyethyl)oxane?
The InChIKey is OPIRTWMWEWQOJJ-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H16O2/c1-9-7-5-8-4-2-3-6-10-8/h8H,2-7H2,1H3/t8-/m0/s1.
What are the key properties of (2S)-2-(2-methoxyethyl)oxane?
(2S)-2-(2-methoxyethyl)oxane has a molecular weight of 144.21 g/mol, XLogP of 1.59, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2-methoxyethyl)oxane is sourced from PubChem (CID 58166172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).