(4S)-3-ethoxy-2,4-dimethyloxolane

C8H16O2 — CID 89332944

IUPAC(4S)-3-ethoxy-2,4-dimethyloxolane
SMILESCCOC1C(C)OC[C@@H]1C
InChIInChI=1S/C8H16O2/c1-4-9-8-6(2)5-10-7(8)3/h6-8H,4-5H2,1-3H3/t6-,7?,8?/m0/s1
InChIKeyQEPNBCDKWOHNQI-KKMMWDRVSA-N
MW144.21 g/mol
LogP1.45
Rot. Bonds2

About (4S)-3-ethoxy-2,4-dimethyloxolane

(4S)-3-ethoxy-2,4-dimethyloxolane (PubChem CID 89332944) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is (4S)-3-ethoxy-2,4-dimethyloxolane.

Molecular Properties

Compound Name(4S)-3-ethoxy-2,4-dimethyloxolane
PubChem CID89332944
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name(4S)-3-ethoxy-2,4-dimethyloxolane
SMILESCCOC1C(C)OC[C@@H]1C
InChIInChI=1S/C8H16O2/c1-4-9-8-6(2)5-10-7(8)3/h6-8H,4-5H2,1-3H3/t6-,7?,8?/m0/s1
InChIKeyQEPNBCDKWOHNQI-KKMMWDRVSA-N
XLogP1.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4S)-3-ethoxy-2,4-dimethyloxolane?
The IUPAC name of (4S)-3-ethoxy-2,4-dimethyloxolane (CID 89332944) is (4S)-3-ethoxy-2,4-dimethyloxolane.
What is the SMILES notation for (4S)-3-ethoxy-2,4-dimethyloxolane?
The canonical SMILES for (4S)-3-ethoxy-2,4-dimethyloxolane is CCOC1C(C)OC[C@@H]1C.
What is the InChIKey of (4S)-3-ethoxy-2,4-dimethyloxolane?
The InChIKey is QEPNBCDKWOHNQI-KKMMWDRVSA-N. The full InChI is InChI=1S/C8H16O2/c1-4-9-8-6(2)5-10-7(8)3/h6-8H,4-5H2,1-3H3/t6-,7?,8?/m0/s1.
What are the key properties of (4S)-3-ethoxy-2,4-dimethyloxolane?
(4S)-3-ethoxy-2,4-dimethyloxolane has a molecular weight of 144.21 g/mol, XLogP of 1.45, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-3-ethoxy-2,4-dimethyloxolane is sourced from PubChem (CID 89332944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).