3-ethyloxolane

C6H12O — CID 10996972

IUPAC3-ethyloxolane
SMILESCCC1CCOC1
InChIInChI=1S/C6H12O/c1-2-6-3-4-7-5-6/h6H,2-5H2,1H3
InChIKeyAIUUAKHKOQFCKF-UHFFFAOYSA-N
MW100.16 g/mol
LogP1.43
Rot. Bonds1

About 3-ethyloxolane

3-ethyloxolane (PubChem CID 10996972) has the molecular formula C6H12O and a molecular weight of 100.16 g/mol. Its IUPAC name is 3-ethyloxolane.

Molecular Properties

Compound Name3-ethyloxolane
PubChem CID10996972
Molecular FormulaC6H12O
Molecular Weight100.16 g/mol
Exact Mass100.09
IUPAC Name3-ethyloxolane
SMILESCCC1CCOC1
InChIInChI=1S/C6H12O/c1-2-6-3-4-7-5-6/h6H,2-5H2,1H3
InChIKeyAIUUAKHKOQFCKF-UHFFFAOYSA-N
XLogP1.43
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.16
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

butane;3-ethyloxolane
CID 143075797
6-ethyl-1,4,8,12-tetraoxacyclopentadecane
CID 123605325
(3S)-3-(2,2-dimethylpropyl)oxolane
CID 139100718
3-(ethylsulfanylmethyl)oxolane
CID 130928771
3-(bromomethyl)oxolane
CID 14173422
sodium oxolan-3-ylmethanesulfonate
CID 23670188
N-methyl-1-[(3R)-oxolan-3-yl]methanamine
CID 30427580
3-(oxolan-3-ylmethyl)pentan-3-ol
CID 14783553
N-(oxolan-3-ylmethyl)propan-1-amine
CID 22355248
ethane;3-(methoxymethyl)oxolane
CID 143285946
2-ethyl-N-(oxolan-3-ylmethyl)cyclopropan-1-amine
CID 103897099
diethyl(oxolan-3-ylmethoxy)alumane
CID 139905311

Frequently Asked Questions

What is the IUPAC name of 3-ethyloxolane?
The IUPAC name of 3-ethyloxolane (CID 10996972) is 3-ethyloxolane.
What is the SMILES notation for 3-ethyloxolane?
The canonical SMILES for 3-ethyloxolane is CCC1CCOC1.
What is the InChIKey of 3-ethyloxolane?
The InChIKey is AIUUAKHKOQFCKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O/c1-2-6-3-4-7-5-6/h6H,2-5H2,1H3.
What are the key properties of 3-ethyloxolane?
3-ethyloxolane has a molecular weight of 100.16 g/mol, XLogP of 1.43, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyloxolane is sourced from PubChem (CID 10996972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).