2-(4-fluorophenyl)-2-methyloxolane

C11H13FO — CID 132520503

IUPAC2-(4-fluorophenyl)-2-methyloxolane
SMILESCC1(c2ccc(F)cc2)CCCO1
InChIInChI=1S/C11H13FO/c1-11(7-2-8-13-11)9-3-5-10(12)6-4-9/h3-6H,2,7-8H2,1H3
InChIKeyYNPGEEYPRXOZMV-UHFFFAOYSA-N
MW180.22 g/mol
LogP2.85
Rot. Bonds1

About 2-(4-fluorophenyl)-2-methyloxolane

2-(4-fluorophenyl)-2-methyloxolane (PubChem CID 132520503) has the molecular formula C11H13FO and a molecular weight of 180.22 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-2-methyloxolane.

Molecular Properties

Compound Name2-(4-fluorophenyl)-2-methyloxolane
PubChem CID132520503
Molecular FormulaC11H13FO
Molecular Weight180.22 g/mol
Exact Mass180.10
IUPAC Name2-(4-fluorophenyl)-2-methyloxolane
SMILESCC1(c2ccc(F)cc2)CCCO1
InChIInChI=1S/C11H13FO/c1-11(7-2-8-13-11)9-3-5-10(12)6-4-9/h3-6H,2,7-8H2,1H3
InChIKeyYNPGEEYPRXOZMV-UHFFFAOYSA-N
XLogP2.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.22
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-2-methyloxolane?
The IUPAC name of 2-(4-fluorophenyl)-2-methyloxolane (CID 132520503) is 2-(4-fluorophenyl)-2-methyloxolane.
What is the SMILES notation for 2-(4-fluorophenyl)-2-methyloxolane?
The canonical SMILES for 2-(4-fluorophenyl)-2-methyloxolane is CC1(c2ccc(F)cc2)CCCO1.
What is the InChIKey of 2-(4-fluorophenyl)-2-methyloxolane?
The InChIKey is YNPGEEYPRXOZMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FO/c1-11(7-2-8-13-11)9-3-5-10(12)6-4-9/h3-6H,2,7-8H2,1H3.
What are the key properties of 2-(4-fluorophenyl)-2-methyloxolane?
2-(4-fluorophenyl)-2-methyloxolane has a molecular weight of 180.22 g/mol, XLogP of 2.85, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-2-methyloxolane is sourced from PubChem (CID 132520503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).