2-(propan-2-yloxymethyl)oxetane

C7H14O2 — CID 156869160

IUPAC2-(propan-2-yloxymethyl)oxetane
SMILESCC(C)OCC1CCO1
InChIInChI=1S/C7H14O2/c1-6(2)9-5-7-3-4-8-7/h6-7H,3-5H2,1-2H3
InChIKeyJRHGYPWVMQNFHT-UHFFFAOYSA-N
MW130.19 g/mol
LogP1.20
Rot. Bonds3

About 2-(propan-2-yloxymethyl)oxetane

2-(propan-2-yloxymethyl)oxetane (PubChem CID 156869160) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is 2-(propan-2-yloxymethyl)oxetane.

Molecular Properties

Compound Name2-(propan-2-yloxymethyl)oxetane
PubChem CID156869160
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Name2-(propan-2-yloxymethyl)oxetane
SMILESCC(C)OCC1CCO1
InChIInChI=1S/C7H14O2/c1-6(2)9-5-7-3-4-8-7/h6-7H,3-5H2,1-2H3
InChIKeyJRHGYPWVMQNFHT-UHFFFAOYSA-N
XLogP1.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(propan-2-yloxymethyl)oxetane?
The IUPAC name of 2-(propan-2-yloxymethyl)oxetane (CID 156869160) is 2-(propan-2-yloxymethyl)oxetane.
What is the SMILES notation for 2-(propan-2-yloxymethyl)oxetane?
The canonical SMILES for 2-(propan-2-yloxymethyl)oxetane is CC(C)OCC1CCO1.
What is the InChIKey of 2-(propan-2-yloxymethyl)oxetane?
The InChIKey is JRHGYPWVMQNFHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O2/c1-6(2)9-5-7-3-4-8-7/h6-7H,3-5H2,1-2H3.
What are the key properties of 2-(propan-2-yloxymethyl)oxetane?
2-(propan-2-yloxymethyl)oxetane has a molecular weight of 130.19 g/mol, XLogP of 1.20, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propan-2-yloxymethyl)oxetane is sourced from PubChem (CID 156869160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).