5-fluoro-2-(3-propan-2-yloxyphenyl)phenol

C15H15FO2 — CID 83130979

IUPAC5-fluoro-2-(3-propan-2-yloxyphenyl)phenol
SMILESCC(C)Oc1cccc(-c2ccc(F)cc2O)c1
InChIInChI=1S/C15H15FO2/c1-10(2)18-13-5-3-4-11(8-13)14-7-6-12(16)9-15(14)17/h3-10,17H,1-2H3
InChIKeyAZOLWHXUFADPRS-UHFFFAOYSA-N
MW246.28 g/mol
LogP3.99
Rot. Bonds3

About 5-fluoro-2-(3-propan-2-yloxyphenyl)phenol

5-fluoro-2-(3-propan-2-yloxyphenyl)phenol (PubChem CID 83130979) has the molecular formula C15H15FO2 and a molecular weight of 246.28 g/mol. Its IUPAC name is 5-fluoro-2-(3-propan-2-yloxyphenyl)phenol.

Molecular Properties

Compound Name5-fluoro-2-(3-propan-2-yloxyphenyl)phenol
PubChem CID83130979
Molecular FormulaC15H15FO2
Molecular Weight246.28 g/mol
Exact Mass246.11
IUPAC Name5-fluoro-2-(3-propan-2-yloxyphenyl)phenol
SMILESCC(C)Oc1cccc(-c2ccc(F)cc2O)c1
InChIInChI=1S/C15H15FO2/c1-10(2)18-13-5-3-4-11(8-13)14-7-6-12(16)9-15(14)17/h3-10,17H,1-2H3
InChIKeyAZOLWHXUFADPRS-UHFFFAOYSA-N
XLogP3.99
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-(3-propan-2-yloxyphenyl)phenol?
The IUPAC name of 5-fluoro-2-(3-propan-2-yloxyphenyl)phenol (CID 83130979) is 5-fluoro-2-(3-propan-2-yloxyphenyl)phenol.
What is the SMILES notation for 5-fluoro-2-(3-propan-2-yloxyphenyl)phenol?
The canonical SMILES for 5-fluoro-2-(3-propan-2-yloxyphenyl)phenol is CC(C)Oc1cccc(-c2ccc(F)cc2O)c1.
What is the InChIKey of 5-fluoro-2-(3-propan-2-yloxyphenyl)phenol?
The InChIKey is AZOLWHXUFADPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FO2/c1-10(2)18-13-5-3-4-11(8-13)14-7-6-12(16)9-15(14)17/h3-10,17H,1-2H3.
What are the key properties of 5-fluoro-2-(3-propan-2-yloxyphenyl)phenol?
5-fluoro-2-(3-propan-2-yloxyphenyl)phenol has a molecular weight of 246.28 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-(3-propan-2-yloxyphenyl)phenol is sourced from PubChem (CID 83130979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).