5-fluoro-2-methylphenol;oxolan-3-ol

C11H15FO3 — CID 144854815

IUPAC5-fluoro-2-methylphenol;oxolan-3-ol
SMILESCc1ccc(F)cc1O.OC1CCOC1
InChIInChI=1S/C7H7FO.C4H8O2/c1-5-2-3-6(8)4-7(5)9;5-4-1-2-6-3-4/h2-4,9H,1H3;4-5H,1-3H2
InChIKeyQCRBFIZYPCMDTE-UHFFFAOYSA-N
MW214.24 g/mol
LogP1.61
Rot. Bonds

About 5-fluoro-2-methylphenol;oxolan-3-ol

5-fluoro-2-methylphenol;oxolan-3-ol (PubChem CID 144854815) has the molecular formula C11H15FO3 and a molecular weight of 214.24 g/mol. Its IUPAC name is 5-fluoro-2-methylphenol;oxolan-3-ol.

Molecular Properties

Compound Name5-fluoro-2-methylphenol;oxolan-3-ol
PubChem CID144854815
Molecular FormulaC11H15FO3
Molecular Weight214.24 g/mol
Exact Mass214.10
IUPAC Name5-fluoro-2-methylphenol;oxolan-3-ol
SMILESCc1ccc(F)cc1O.OC1CCOC1
InChIInChI=1S/C7H7FO.C4H8O2/c1-5-2-3-6(8)4-7(5)9;5-4-1-2-6-3-4/h2-4,9H,1H3;4-5H,1-3H2
InChIKeyQCRBFIZYPCMDTE-UHFFFAOYSA-N
XLogP1.61
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.24
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methylphenol;oxolan-3-ol?
The IUPAC name of 5-fluoro-2-methylphenol;oxolan-3-ol (CID 144854815) is 5-fluoro-2-methylphenol;oxolan-3-ol.
What is the SMILES notation for 5-fluoro-2-methylphenol;oxolan-3-ol?
The canonical SMILES for 5-fluoro-2-methylphenol;oxolan-3-ol is Cc1ccc(F)cc1O.OC1CCOC1.
What is the InChIKey of 5-fluoro-2-methylphenol;oxolan-3-ol?
The InChIKey is QCRBFIZYPCMDTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FO.C4H8O2/c1-5-2-3-6(8)4-7(5)9;5-4-1-2-6-3-4/h2-4,9H,1H3;4-5H,1-3H2.
What are the key properties of 5-fluoro-2-methylphenol;oxolan-3-ol?
5-fluoro-2-methylphenol;oxolan-3-ol has a molecular weight of 214.24 g/mol, XLogP of 1.61, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methylphenol;oxolan-3-ol is sourced from PubChem (CID 144854815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).