1-(oxolan-2-yloxy)propan-2-ol

C7H14O3 — CID 172822303

IUPAC1-(oxolan-2-yloxy)propan-2-ol
SMILESCC(O)COC1CCCO1
InChIInChI=1S/C7H14O3/c1-6(8)5-10-7-3-2-4-9-7/h6-8H,2-5H2,1H3
InChIKeyUJTWXOMXBYTDSO-UHFFFAOYSA-N
MW146.19 g/mol
LogP0.52
Rot. Bonds3

About 1-(oxolan-2-yloxy)propan-2-ol

1-(oxolan-2-yloxy)propan-2-ol (PubChem CID 172822303) has the molecular formula C7H14O3 and a molecular weight of 146.19 g/mol. Its IUPAC name is 1-(oxolan-2-yloxy)propan-2-ol.

Molecular Properties

Compound Name1-(oxolan-2-yloxy)propan-2-ol
PubChem CID172822303
Molecular FormulaC7H14O3
Molecular Weight146.19 g/mol
Exact Mass146.09
IUPAC Name1-(oxolan-2-yloxy)propan-2-ol
SMILESCC(O)COC1CCCO1
InChIInChI=1S/C7H14O3/c1-6(8)5-10-7-3-2-4-9-7/h6-8H,2-5H2,1H3
InChIKeyUJTWXOMXBYTDSO-UHFFFAOYSA-N
XLogP0.52
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(methylamino)-5-(oxolan-2-yloxy)pentane-2,3-diol
CID 153374045
2-amino-1-(oxolan-2-yloxy)pentan-3-ol
CID 153374047
2-[1,3,4-tris(oxolan-2-yloxy)butan-2-yloxy]oxolane
CID 169311786
2-(2,3,3-trimethylbutoxy)oxane
CID 145356481
methyl (2R)-2-methyl-3-[(2R)-oxan-2-yl]oxypropanoate
CID 92975409
methyl (2S)-2-methyl-3-(oxan-2-yloxy)propanoate
CID 11195022
2-[(E,2R)-4-iodo-2-methylpent-3-enoxy]oxane
CID 10870601
2,6-dimethyl-7-(oxan-2-yloxy)heptan-1-ol
CID 85158047
2-[(2R)-4-iodo-2-methylbutoxy]oxane
CID 11779415
2-[(2R)-2-methylpentoxy]oxane
CID 57327472
2-(4-bromo-2,3-dimethylbutoxy)oxane
CID 14731941
1,3-bis[4-(oxan-2-yloxy)butoxy]propan-2-ol
CID 171403121

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-yloxy)propan-2-ol?
The IUPAC name of 1-(oxolan-2-yloxy)propan-2-ol (CID 172822303) is 1-(oxolan-2-yloxy)propan-2-ol.
What is the SMILES notation for 1-(oxolan-2-yloxy)propan-2-ol?
The canonical SMILES for 1-(oxolan-2-yloxy)propan-2-ol is CC(O)COC1CCCO1.
What is the InChIKey of 1-(oxolan-2-yloxy)propan-2-ol?
The InChIKey is UJTWXOMXBYTDSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O3/c1-6(8)5-10-7-3-2-4-9-7/h6-8H,2-5H2,1H3.
What are the key properties of 1-(oxolan-2-yloxy)propan-2-ol?
1-(oxolan-2-yloxy)propan-2-ol has a molecular weight of 146.19 g/mol, XLogP of 0.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-yloxy)propan-2-ol is sourced from PubChem (CID 172822303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).