2-ethyl-2-propyloxetane

C8H16O — CID 19381995

IUPAC2-ethyl-2-propyloxetane
SMILESCCCC1(CC)CCO1
InChIInChI=1S/C8H16O/c1-3-5-8(4-2)6-7-9-8/h3-7H2,1-2H3
InChIKeyOGSOZNBGLCHAIB-UHFFFAOYSA-N
MW128.22 g/mol
LogP2.36
Rot. Bonds3

About 2-ethyl-2-propyloxetane

2-ethyl-2-propyloxetane (PubChem CID 19381995) has the molecular formula C8H16O and a molecular weight of 128.22 g/mol. Its IUPAC name is 2-ethyl-2-propyloxetane.

Molecular Properties

Compound Name2-ethyl-2-propyloxetane
PubChem CID19381995
Molecular FormulaC8H16O
Molecular Weight128.22 g/mol
Exact Mass128.12
IUPAC Name2-ethyl-2-propyloxetane
SMILESCCCC1(CC)CCO1
InChIInChI=1S/C8H16O/c1-3-5-8(4-2)6-7-9-8/h3-7H2,1-2H3
InChIKeyOGSOZNBGLCHAIB-UHFFFAOYSA-N
XLogP2.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
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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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-propyloxetane?
The IUPAC name of 2-ethyl-2-propyloxetane (CID 19381995) is 2-ethyl-2-propyloxetane.
What is the SMILES notation for 2-ethyl-2-propyloxetane?
The canonical SMILES for 2-ethyl-2-propyloxetane is CCCC1(CC)CCO1.
What is the InChIKey of 2-ethyl-2-propyloxetane?
The InChIKey is OGSOZNBGLCHAIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O/c1-3-5-8(4-2)6-7-9-8/h3-7H2,1-2H3.
What are the key properties of 2-ethyl-2-propyloxetane?
2-ethyl-2-propyloxetane has a molecular weight of 128.22 g/mol, XLogP of 2.36, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-propyloxetane is sourced from PubChem (CID 19381995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).