3-(5-fluoro-2-methylphenyl)oxolan-3-ol

C11H13FO2 — CID 63331828

IUPAC3-(5-fluoro-2-methylphenyl)oxolan-3-ol
SMILESCc1ccc(F)cc1C1(O)CCOC1
InChIInChI=1S/C11H13FO2/c1-8-2-3-9(12)6-10(8)11(13)4-5-14-7-11/h2-3,6,13H,4-5,7H2,1H3
InChIKeyHVIYZDHVIZOCQD-UHFFFAOYSA-N
MW196.22 g/mol
LogP1.74
Rot. Bonds1

About 3-(5-fluoro-2-methylphenyl)oxolan-3-ol

3-(5-fluoro-2-methylphenyl)oxolan-3-ol (PubChem CID 63331828) has the molecular formula C11H13FO2 and a molecular weight of 196.22 g/mol. Its IUPAC name is 3-(5-fluoro-2-methylphenyl)oxolan-3-ol.

Molecular Properties

Compound Name3-(5-fluoro-2-methylphenyl)oxolan-3-ol
PubChem CID63331828
Molecular FormulaC11H13FO2
Molecular Weight196.22 g/mol
Exact Mass196.09
IUPAC Name3-(5-fluoro-2-methylphenyl)oxolan-3-ol
SMILESCc1ccc(F)cc1C1(O)CCOC1
InChIInChI=1S/C11H13FO2/c1-8-2-3-9(12)6-10(8)11(13)4-5-14-7-11/h2-3,6,13H,4-5,7H2,1H3
InChIKeyHVIYZDHVIZOCQD-UHFFFAOYSA-N
XLogP1.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(5-fluoro-2-methylphenyl)oxolan-3-ol?
The IUPAC name of 3-(5-fluoro-2-methylphenyl)oxolan-3-ol (CID 63331828) is 3-(5-fluoro-2-methylphenyl)oxolan-3-ol.
What is the SMILES notation for 3-(5-fluoro-2-methylphenyl)oxolan-3-ol?
The canonical SMILES for 3-(5-fluoro-2-methylphenyl)oxolan-3-ol is Cc1ccc(F)cc1C1(O)CCOC1.
What is the InChIKey of 3-(5-fluoro-2-methylphenyl)oxolan-3-ol?
The InChIKey is HVIYZDHVIZOCQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FO2/c1-8-2-3-9(12)6-10(8)11(13)4-5-14-7-11/h2-3,6,13H,4-5,7H2,1H3.
What are the key properties of 3-(5-fluoro-2-methylphenyl)oxolan-3-ol?
3-(5-fluoro-2-methylphenyl)oxolan-3-ol has a molecular weight of 196.22 g/mol, XLogP of 1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-fluoro-2-methylphenyl)oxolan-3-ol is sourced from PubChem (CID 63331828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).