(2,5-dimethoxyoxolan-3-yl)methanol

C7H14O4 — CID 14437427

IUPAC(2,5-dimethoxyoxolan-3-yl)methanol
SMILESCOC1CC(CO)C(OC)O1
InChIInChI=1S/C7H14O4/c1-9-6-3-5(4-8)7(10-2)11-6/h5-8H,3-4H2,1-2H3
InChIKeyNHGAIGDDBFHIKX-UHFFFAOYSA-N
MW162.18 g/mol
LogP-0.04
Rot. Bonds3

About (2,5-dimethoxyoxolan-3-yl)methanol

(2,5-dimethoxyoxolan-3-yl)methanol (PubChem CID 14437427) has the molecular formula C7H14O4 and a molecular weight of 162.18 g/mol. Its IUPAC name is (2,5-dimethoxyoxolan-3-yl)methanol.

Molecular Properties

Compound Name(2,5-dimethoxyoxolan-3-yl)methanol
PubChem CID14437427
Molecular FormulaC7H14O4
Molecular Weight162.18 g/mol
Exact Mass162.09
IUPAC Name(2,5-dimethoxyoxolan-3-yl)methanol
SMILESCOC1CC(CO)C(OC)O1
InChIInChI=1S/C7H14O4/c1-9-6-3-5(4-8)7(10-2)11-6/h5-8H,3-4H2,1-2H3
InChIKeyNHGAIGDDBFHIKX-UHFFFAOYSA-N
XLogP-0.04
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.18
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2,5-dimethoxyoxolan-3-yl)methanol?
The IUPAC name of (2,5-dimethoxyoxolan-3-yl)methanol (CID 14437427) is (2,5-dimethoxyoxolan-3-yl)methanol.
What is the SMILES notation for (2,5-dimethoxyoxolan-3-yl)methanol?
The canonical SMILES for (2,5-dimethoxyoxolan-3-yl)methanol is COC1CC(CO)C(OC)O1.
What is the InChIKey of (2,5-dimethoxyoxolan-3-yl)methanol?
The InChIKey is NHGAIGDDBFHIKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O4/c1-9-6-3-5(4-8)7(10-2)11-6/h5-8H,3-4H2,1-2H3.
What are the key properties of (2,5-dimethoxyoxolan-3-yl)methanol?
(2,5-dimethoxyoxolan-3-yl)methanol has a molecular weight of 162.18 g/mol, XLogP of -0.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethoxyoxolan-3-yl)methanol is sourced from PubChem (CID 14437427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).