3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol

C10H20O3 — CID 163533132

IUPAC3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol
SMILESCCOC1(CCCO)CC(C)CO1
InChIInChI=1S/C10H20O3/c1-3-12-10(5-4-6-11)7-9(2)8-13-10/h9,11H,3-8H2,1-2H3
InChIKeyDURLYXWOSAMQNQ-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.55
Rot. Bonds5

About 3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol

3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol (PubChem CID 163533132) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is 3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol
PubChem CID163533132
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol
SMILESCCOC1(CCCO)CC(C)CO1
InChIInChI=1S/C10H20O3/c1-3-12-10(5-4-6-11)7-9(2)8-13-10/h9,11H,3-8H2,1-2H3
InChIKeyDURLYXWOSAMQNQ-UHFFFAOYSA-N
XLogP1.55
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol?
The IUPAC name of 3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol (CID 163533132) is 3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol.
What is the SMILES notation for 3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol?
The canonical SMILES for 3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol is CCOC1(CCCO)CC(C)CO1.
What is the InChIKey of 3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol?
The InChIKey is DURLYXWOSAMQNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3/c1-3-12-10(5-4-6-11)7-9(2)8-13-10/h9,11H,3-8H2,1-2H3.
What are the key properties of 3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol?
3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol has a molecular weight of 188.27 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxy-4-methyloxolan-2-yl)propan-1-ol is sourced from PubChem (CID 163533132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).