2-(2-methylphenoxy)oxetane

C10H12O2 — CID 23394730

IUPAC2-(2-methylphenoxy)oxetane
SMILESCc1ccccc1OC1CCO1
InChIInChI=1S/C10H12O2/c1-8-4-2-3-5-9(8)12-10-6-7-11-10/h2-5,10H,6-7H2,1H3
InChIKeyIGOPVNLTICVCLL-UHFFFAOYSA-N
MW164.20 g/mol
LogP2.12
Rot. Bonds2

About 2-(2-methylphenoxy)oxetane

2-(2-methylphenoxy)oxetane (PubChem CID 23394730) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is 2-(2-methylphenoxy)oxetane.

Molecular Properties

Compound Name2-(2-methylphenoxy)oxetane
PubChem CID23394730
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name2-(2-methylphenoxy)oxetane
SMILESCc1ccccc1OC1CCO1
InChIInChI=1S/C10H12O2/c1-8-4-2-3-5-9(8)12-10-6-7-11-10/h2-5,10H,6-7H2,1H3
InChIKeyIGOPVNLTICVCLL-UHFFFAOYSA-N
XLogP2.12
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenoxy)oxetane?
The IUPAC name of 2-(2-methylphenoxy)oxetane (CID 23394730) is 2-(2-methylphenoxy)oxetane.
What is the SMILES notation for 2-(2-methylphenoxy)oxetane?
The canonical SMILES for 2-(2-methylphenoxy)oxetane is Cc1ccccc1OC1CCO1.
What is the InChIKey of 2-(2-methylphenoxy)oxetane?
The InChIKey is IGOPVNLTICVCLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c1-8-4-2-3-5-9(8)12-10-6-7-11-10/h2-5,10H,6-7H2,1H3.
What are the key properties of 2-(2-methylphenoxy)oxetane?
2-(2-methylphenoxy)oxetane has a molecular weight of 164.20 g/mol, XLogP of 2.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenoxy)oxetane is sourced from PubChem (CID 23394730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).