2-fluoro-3-propan-2-ylphenol

C9H11FO — CID 71302551

IUPAC2-fluoro-3-propan-2-ylphenol
SMILESCC(C)c1cccc(O)c1F
InChIInChI=1S/C9H11FO/c1-6(2)7-4-3-5-8(11)9(7)10/h3-6,11H,1-2H3
InChIKeyHYBMZTXUJPJEDC-UHFFFAOYSA-N
MW154.18 g/mol
LogP2.65
Rot. Bonds1

About 2-fluoro-3-propan-2-ylphenol

2-fluoro-3-propan-2-ylphenol (PubChem CID 71302551) has the molecular formula C9H11FO and a molecular weight of 154.18 g/mol. Its IUPAC name is 2-fluoro-3-propan-2-ylphenol.

Molecular Properties

Compound Name2-fluoro-3-propan-2-ylphenol
PubChem CID71302551
Molecular FormulaC9H11FO
Molecular Weight154.18 g/mol
Exact Mass154.08
IUPAC Name2-fluoro-3-propan-2-ylphenol
SMILESCC(C)c1cccc(O)c1F
InChIInChI=1S/C9H11FO/c1-6(2)7-4-3-5-8(11)9(7)10/h3-6,11H,1-2H3
InChIKeyHYBMZTXUJPJEDC-UHFFFAOYSA-N
XLogP2.65
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.18
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-fluoro-2,4-di(propan-2-yl)phenol
CID 174716434
3-[(1R)-1-amino-2,2-dimethylpropyl]-2-fluorophenol
CID 131151312
2,6-di(propan-2-yl)phenol;silver
CID 174803720
2-bromo-3-propan-2-ylphenol
CID 23114133
2-chloro-3-fluoro-4-propan-2-ylphenol
CID 137471064
1-ethyl-2-fluoro-3-propan-2-ylbenzene
CID 54146426
lithium;hydride;2-propan-2-ylphenol
CID 175276368
bis(2,6-di(propan-2-yl)phenol);titanium(2+);dichloride
CID 87638376
bis(2,6-di(propan-2-yl)phenol);titanium;dihydrochloride
CID 87638377
bis(2-propan-2-ylphenol);zirconium(2+);dichloride
CID 174391119
8-propan-2-ylnaphthalen-1-ol
CID 10465049
dimethylalumane;tris(2,6-di(propan-2-yl)phenol)
CID 173121880

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-propan-2-ylphenol?
The IUPAC name of 2-fluoro-3-propan-2-ylphenol (CID 71302551) is 2-fluoro-3-propan-2-ylphenol.
What is the SMILES notation for 2-fluoro-3-propan-2-ylphenol?
The canonical SMILES for 2-fluoro-3-propan-2-ylphenol is CC(C)c1cccc(O)c1F.
What is the InChIKey of 2-fluoro-3-propan-2-ylphenol?
The InChIKey is HYBMZTXUJPJEDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FO/c1-6(2)7-4-3-5-8(11)9(7)10/h3-6,11H,1-2H3.
What are the key properties of 2-fluoro-3-propan-2-ylphenol?
2-fluoro-3-propan-2-ylphenol has a molecular weight of 154.18 g/mol, XLogP of 2.65, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-propan-2-ylphenol is sourced from PubChem (CID 71302551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).