2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol

C9H16O4 — CID 102607300

IUPAC2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol
SMILESOC(COC1COC1)C1CCOC1
InChIInChI=1S/C9H16O4/c10-9(7-1-2-11-3-7)6-13-8-4-12-5-8/h7-10H,1-6H2
InChIKeySALUFGBBGRZFPJ-UHFFFAOYSA-N
MW188.22 g/mol
LogP-0.20
Rot. Bonds4

About 2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol

2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol (PubChem CID 102607300) has the molecular formula C9H16O4 and a molecular weight of 188.22 g/mol. Its IUPAC name is 2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol.

Molecular Properties

Compound Name2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol
PubChem CID102607300
Molecular FormulaC9H16O4
Molecular Weight188.22 g/mol
Exact Mass188.10
IUPAC Name2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol
SMILESOC(COC1COC1)C1CCOC1
InChIInChI=1S/C9H16O4/c10-9(7-1-2-11-3-7)6-13-8-4-12-5-8/h7-10H,1-6H2
InChIKeySALUFGBBGRZFPJ-UHFFFAOYSA-N
XLogP-0.20
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.22
LogP ≤ 5-0.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-2-bromo-1-[(3S)-oxolan-3-yl]ethanol
CID 124679633
(1S)-2-amino-1-[(3R)-oxolan-3-yl]ethanol
CID 93046962
2-(2-ethylcyclohexyl)oxy-1-(oxolan-3-yl)ethanol
CID 104753532
2-(cyclopentylmethoxy)-1-(oxolan-3-yl)ethanol
CID 104753738
2-hexoxy-1-(oxolan-3-yl)ethanol
CID 104753611
1-(oxolan-3-yl)but-3-en-1-ol
CID 65329899
2-[cyclopropyl(2-methylpropyl)amino]-1-(oxolan-3-yl)ethanol
CID 104752635
1-(oxolan-3-yl)-2-(2,2,3,3-tetrafluoropropoxy)ethanol
CID 104753405
(2R)-1-(oxetan-3-yloxy)butan-2-ol
CID 124603359
(2S)-1-(oxetan-3-yloxy)butan-2-ol
CID 124603358
4-methoxy-1-(oxolan-3-yl)pentan-1-ol
CID 105097696
2-(3,5-difluorophenoxy)-1-(oxolan-3-yl)ethanol
CID 104753703

Frequently Asked Questions

What is the IUPAC name of 2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol?
The IUPAC name of 2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol (CID 102607300) is 2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol.
What is the SMILES notation for 2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol?
The canonical SMILES for 2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol is OC(COC1COC1)C1CCOC1.
What is the InChIKey of 2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol?
The InChIKey is SALUFGBBGRZFPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O4/c10-9(7-1-2-11-3-7)6-13-8-4-12-5-8/h7-10H,1-6H2.
What are the key properties of 2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol?
2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol has a molecular weight of 188.22 g/mol, XLogP of -0.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxetan-3-yloxy)-1-(oxolan-3-yl)ethanol is sourced from PubChem (CID 102607300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).