4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol

C7H3BrF5NO2 — CID 118845193

IUPAC4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol
SMILESOc1c(Br)cc(OC(F)(F)F)nc1C(F)F
InChIInChI=1S/C7H3BrF5NO2/c8-2-1-3(16-7(11,12)13)14-4(5(2)15)6(9)10/h1,6,15H
InChIKeyKFXOFCCYRDZGLM-UHFFFAOYSA-N
MW308.00 g/mol
LogP3.39
Rot. Bonds2

About 4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol

4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol (PubChem CID 118845193) has the molecular formula C7H3BrF5NO2 and a molecular weight of 308.00 g/mol. Its IUPAC name is 4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol.

Molecular Properties

Compound Name4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol
PubChem CID118845193
Molecular FormulaC7H3BrF5NO2
Molecular Weight308.00 g/mol
Exact Mass306.93
IUPAC Name4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol
SMILESOc1c(Br)cc(OC(F)(F)F)nc1C(F)F
InChIInChI=1S/C7H3BrF5NO2/c8-2-1-3(16-7(11,12)13)14-4(5(2)15)6(9)10/h1,6,15H
InChIKeyKFXOFCCYRDZGLM-UHFFFAOYSA-N
XLogP3.39
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.00
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(difluoromethyl)-4-fluoro-6-(trifluoromethoxy)pyridin-3-ol
CID 118799496
4-bromo-2-(difluoromethyl)-3-nitro-6-(trifluoromethoxy)pyridine
CID 118816776
4-(difluoromethyl)-2-iodo-6-(trifluoromethoxy)pyridin-3-ol
CID 118823942
methyl 2-(difluoromethyl)-4-iodo-6-(trifluoromethoxy)pyridine-3-carboxylate
CID 134659257
3-(bromomethyl)-2-(difluoromethyl)-6-(trifluoromethoxy)pyridine-4-carboxylic acid
CID 134665192
2,4-dibromo-6-(trifluoromethoxy)pyridin-3-amine
CID 130093565
2-(difluoromethyl)-4-methyl-6-(trifluoromethoxy)pyridine-3-carboxylic acid
CID 118803490
4-(bromomethyl)-2-(difluoromethyl)-3-methoxy-6-(trifluoromethoxy)pyridine
CID 134668892
4-(aminomethyl)-2-(difluoromethyl)-6-(trifluoromethoxy)pyridine-3-sulfonamide
CID 118846600
2-(difluoromethyl)-3-methyl-6-(trifluoromethoxy)pyridine-4-carbaldehyde
CID 118831628
2-[4-bromo-6-(difluoromethyl)-5-hydroxy-2-pyridinyl]acetic acid
CID 118800091
3-(chloromethyl)-2-(difluoromethyl)-6-(trifluoromethoxy)pyridine-4-carbonyl chloride
CID 134663465

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol?
The IUPAC name of 4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol (CID 118845193) is 4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol.
What is the SMILES notation for 4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol?
The canonical SMILES for 4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol is Oc1c(Br)cc(OC(F)(F)F)nc1C(F)F.
What is the InChIKey of 4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol?
The InChIKey is KFXOFCCYRDZGLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3BrF5NO2/c8-2-1-3(16-7(11,12)13)14-4(5(2)15)6(9)10/h1,6,15H.
What are the key properties of 4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol?
4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol has a molecular weight of 308.00 g/mol, XLogP of 3.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-(difluoromethyl)-6-(trifluoromethoxy)pyridin-3-ol is sourced from PubChem (CID 118845193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).