2-(3-propan-2-yloxetan-3-yl)oxyethanol

C8H16O3 — CID 162406288

IUPAC2-(3-propan-2-yloxetan-3-yl)oxyethanol
SMILESCC(C)C1(OCCO)COC1
InChIInChI=1S/C8H16O3/c1-7(2)8(5-10-6-8)11-4-3-9/h7,9H,3-6H2,1-2H3
InChIKeyIXXGQEXYWVWFTK-UHFFFAOYSA-N
MW160.21 g/mol
LogP0.42
Rot. Bonds4

About 2-(3-propan-2-yloxetan-3-yl)oxyethanol

2-(3-propan-2-yloxetan-3-yl)oxyethanol (PubChem CID 162406288) has the molecular formula C8H16O3 and a molecular weight of 160.21 g/mol. Its IUPAC name is 2-(3-propan-2-yloxetan-3-yl)oxyethanol.

Molecular Properties

Compound Name2-(3-propan-2-yloxetan-3-yl)oxyethanol
PubChem CID162406288
Molecular FormulaC8H16O3
Molecular Weight160.21 g/mol
Exact Mass160.11
IUPAC Name2-(3-propan-2-yloxetan-3-yl)oxyethanol
SMILESCC(C)C1(OCCO)COC1
InChIInChI=1S/C8H16O3/c1-7(2)8(5-10-6-8)11-4-3-9/h7,9H,3-6H2,1-2H3
InChIKeyIXXGQEXYWVWFTK-UHFFFAOYSA-N
XLogP0.42
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.21
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-propan-2-yloxetan-3-yl)oxyethanol?
The IUPAC name of 2-(3-propan-2-yloxetan-3-yl)oxyethanol (CID 162406288) is 2-(3-propan-2-yloxetan-3-yl)oxyethanol.
What is the SMILES notation for 2-(3-propan-2-yloxetan-3-yl)oxyethanol?
The canonical SMILES for 2-(3-propan-2-yloxetan-3-yl)oxyethanol is CC(C)C1(OCCO)COC1.
What is the InChIKey of 2-(3-propan-2-yloxetan-3-yl)oxyethanol?
The InChIKey is IXXGQEXYWVWFTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O3/c1-7(2)8(5-10-6-8)11-4-3-9/h7,9H,3-6H2,1-2H3.
What are the key properties of 2-(3-propan-2-yloxetan-3-yl)oxyethanol?
2-(3-propan-2-yloxetan-3-yl)oxyethanol has a molecular weight of 160.21 g/mol, XLogP of 0.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-propan-2-yloxetan-3-yl)oxyethanol is sourced from PubChem (CID 162406288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).