3-ethyl-2-propyloxetane

C8H16O — CID 14088496

IUPAC3-ethyl-2-propyloxetane
SMILESCCCC1OCC1CC
InChIInChI=1S/C8H16O/c1-3-5-8-7(4-2)6-9-8/h7-8H,3-6H2,1-2H3
InChIKeyVVXQOMGRTXHFBZ-UHFFFAOYSA-N
MW128.22 g/mol
LogP2.21
Rot. Bonds3

About 3-ethyl-2-propyloxetane

3-ethyl-2-propyloxetane (PubChem CID 14088496) has the molecular formula C8H16O and a molecular weight of 128.22 g/mol. Its IUPAC name is 3-ethyl-2-propyloxetane.

Molecular Properties

Compound Name3-ethyl-2-propyloxetane
PubChem CID14088496
Molecular FormulaC8H16O
Molecular Weight128.22 g/mol
Exact Mass128.12
IUPAC Name3-ethyl-2-propyloxetane
SMILESCCCC1OCC1CC
InChIInChI=1S/C8H16O/c1-3-5-8-7(4-2)6-9-8/h7-8H,3-6H2,1-2H3
InChIKeyVVXQOMGRTXHFBZ-UHFFFAOYSA-N
XLogP2.21
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 ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(Butoxymethyl)heptane
CID 522064
1-Isobutoxy-2-ethylhexane
CID 545495
3-((1,1-Dimethylethoxy)methyl)heptane
CID 545858
3-Methoxy-4-methylheptane
CID 89207464
(1,3-Epoxypropyl)cyclohexane
CID 12709676
2,4,6-Trimethyltetrahydropyrane
CID 13776990
2-n-Propyl-3-methyl-tetrahydrofuran
CID 18965607
1-(4-Methylpentan-2-yloxy)octane
CID 19370012
2,6-Dimethyl-4-ethyltetrahydropyrane
CID 22965776
2-Methyl-3-propyltetrahydropyran
CID 57486098
(3S,6S)-2,3,4,5,6-pentamethyloxane
CID 59823957
Methyl tern-butyl ether
CID 129817504

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-propyloxetane?
The IUPAC name of 3-ethyl-2-propyloxetane (CID 14088496) is 3-ethyl-2-propyloxetane.
What is the SMILES notation for 3-ethyl-2-propyloxetane?
The canonical SMILES for 3-ethyl-2-propyloxetane is CCCC1OCC1CC.
What is the InChIKey of 3-ethyl-2-propyloxetane?
The InChIKey is VVXQOMGRTXHFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O/c1-3-5-8-7(4-2)6-9-8/h7-8H,3-6H2,1-2H3.
What are the key properties of 3-ethyl-2-propyloxetane?
3-ethyl-2-propyloxetane has a molecular weight of 128.22 g/mol, XLogP of 2.21, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-propyloxetane is sourced from PubChem (CID 14088496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).