2-fluoro-6-(trifluoromethoxy)phenol

C7H4F4O2 — CID 68960936

IUPAC2-fluoro-6-(trifluoromethoxy)phenol
SMILESOc1c(F)cccc1OC(F)(F)F
InChIInChI=1S/C7H4F4O2/c8-4-2-1-3-5(6(4)12)13-7(9,10)11/h1-3,12H
InChIKeyOENLDLKWOLIXAM-UHFFFAOYSA-N
MW196.10 g/mol
LogP2.43
Rot. Bonds1

About 2-fluoro-6-(trifluoromethoxy)phenol

2-fluoro-6-(trifluoromethoxy)phenol (PubChem CID 68960936) has the molecular formula C7H4F4O2 and a molecular weight of 196.10 g/mol. Its IUPAC name is 2-fluoro-6-(trifluoromethoxy)phenol.

Molecular Properties

Compound Name2-fluoro-6-(trifluoromethoxy)phenol
PubChem CID68960936
Molecular FormulaC7H4F4O2
Molecular Weight196.10 g/mol
Exact Mass196.01
IUPAC Name2-fluoro-6-(trifluoromethoxy)phenol
SMILESOc1c(F)cccc1OC(F)(F)F
InChIInChI=1S/C7H4F4O2/c8-4-2-1-3-5(6(4)12)13-7(9,10)11/h1-3,12H
InChIKeyOENLDLKWOLIXAM-UHFFFAOYSA-N
XLogP2.43
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.10
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-hydroxy-3-(trifluoromethoxy)phenoxy]boronic acid
CID 172837844
1,3-difluoro-2-[2-(trifluoromethoxy)phenyl]benzene
CID 22617307
2-hydroxy-3-(trifluoromethoxy)benzenesulfonyl chloride
CID 122199046
2-[(1S)-1-aminoethyl]-6-(trifluoromethoxy)phenol;hydrochloride
CID 171255504
2-ethyl-1-fluoro-3-(trifluoromethoxy)benzene
CID 131169258
[2-fluoro-6-(trifluoromethoxy)phenyl]-trimethylsilane
CID 130887483
2-[(1S)-1-amino-2-hydroxyethyl]-6-(trifluoromethoxy)phenol
CID 66514766
2-[(1S)-1-amino-2-fluoroethyl]-6-(trifluoromethoxy)phenol;hydrochloride
CID 171258866
1-fluoro-2-[2-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)benzene
CID 134631115
2-fluoro-3-(trifluoromethoxy)benzoyl fluoride
CID 88701433
2-[(S)-amino-[4-(trifluoromethoxy)phenyl]methyl]-6-fluorophenol
CID 171239131
2-[(1S)-1-amino-3-hydroxy-2,2-dimethylpropyl]-6-(trifluoromethoxy)phenol
CID 171255546

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-(trifluoromethoxy)phenol?
The IUPAC name of 2-fluoro-6-(trifluoromethoxy)phenol (CID 68960936) is 2-fluoro-6-(trifluoromethoxy)phenol.
What is the SMILES notation for 2-fluoro-6-(trifluoromethoxy)phenol?
The canonical SMILES for 2-fluoro-6-(trifluoromethoxy)phenol is Oc1c(F)cccc1OC(F)(F)F.
What is the InChIKey of 2-fluoro-6-(trifluoromethoxy)phenol?
The InChIKey is OENLDLKWOLIXAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F4O2/c8-4-2-1-3-5(6(4)12)13-7(9,10)11/h1-3,12H.
What are the key properties of 2-fluoro-6-(trifluoromethoxy)phenol?
2-fluoro-6-(trifluoromethoxy)phenol has a molecular weight of 196.10 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-(trifluoromethoxy)phenol is sourced from PubChem (CID 68960936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).