2-(4-methoxyphenyl)-4-methyloxolane

C12H16O2 — CID 12007912

IUPAC2-(4-methoxyphenyl)-4-methyloxolane
SMILESCOc1ccc(C2CC(C)CO2)cc1
InChIInChI=1S/C12H16O2/c1-9-7-12(14-8-9)10-3-5-11(13-2)6-4-10/h3-6,9,12H,7-8H2,1-2H3
InChIKeyZVFQBUJJSRHEIA-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.79
Rot. Bonds2

About 2-(4-methoxyphenyl)-4-methyloxolane

2-(4-methoxyphenyl)-4-methyloxolane (PubChem CID 12007912) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-4-methyloxolane.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-4-methyloxolane
PubChem CID12007912
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name2-(4-methoxyphenyl)-4-methyloxolane
SMILESCOc1ccc(C2CC(C)CO2)cc1
InChIInChI=1S/C12H16O2/c1-9-7-12(14-8-9)10-3-5-11(13-2)6-4-10/h3-6,9,12H,7-8H2,1-2H3
InChIKeyZVFQBUJJSRHEIA-UHFFFAOYSA-N
XLogP2.79
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-4-methyloxolane?
The IUPAC name of 2-(4-methoxyphenyl)-4-methyloxolane (CID 12007912) is 2-(4-methoxyphenyl)-4-methyloxolane.
What is the SMILES notation for 2-(4-methoxyphenyl)-4-methyloxolane?
The canonical SMILES for 2-(4-methoxyphenyl)-4-methyloxolane is COc1ccc(C2CC(C)CO2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-4-methyloxolane?
The InChIKey is ZVFQBUJJSRHEIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2/c1-9-7-12(14-8-9)10-3-5-11(13-2)6-4-10/h3-6,9,12H,7-8H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-4-methyloxolane?
2-(4-methoxyphenyl)-4-methyloxolane has a molecular weight of 192.26 g/mol, XLogP of 2.79, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-4-methyloxolane is sourced from PubChem (CID 12007912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).