6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol

C7H3ClF5NO — CID 119000260

IUPAC6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol
SMILESOc1cnc(Cl)c(C(F)(F)F)c1C(F)F
InChIInChI=1S/C7H3ClF5NO/c8-5-4(7(11,12)13)3(6(9)10)2(15)1-14-5/h1,6,15H
InChIKeySQCYEUAJLJRRIL-UHFFFAOYSA-N
MW247.55 g/mol
LogP3.40
Rot. Bonds1

About 6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol

6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol (PubChem CID 119000260) has the molecular formula C7H3ClF5NO and a molecular weight of 247.55 g/mol. Its IUPAC name is 6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol.

Molecular Properties

Compound Name6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol
PubChem CID119000260
Molecular FormulaC7H3ClF5NO
Molecular Weight247.55 g/mol
Exact Mass246.98
IUPAC Name6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol
SMILESOc1cnc(Cl)c(C(F)(F)F)c1C(F)F
InChIInChI=1S/C7H3ClF5NO/c8-5-4(7(11,12)13)3(6(9)10)2(15)1-14-5/h1,6,15H
InChIKeySQCYEUAJLJRRIL-UHFFFAOYSA-N
XLogP3.40
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.55
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-chloro-4-(difluoromethyl)-5-methylpyridin-3-ol
CID 119014799
6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol
CID 118998226
2-chloro-5-(chloromethyl)-3-(difluoromethyl)-4-(trifluoromethyl)pyridine
CID 119009541
3-(difluoromethyl)-5-hydroxy-4-(trifluoromethyl)pyridine-2-carboxylic acid
CID 133102250
6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol
CID 130107825
6-chloro-5-(difluoromethyl)-4-methoxypyridin-3-ol
CID 119013301
2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide
CID 130072896
6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol
CID 118825681
6-(difluoromethyl)-4-(hydroxymethyl)-5-(trifluoromethyl)pyridin-3-ol
CID 130085374
2-bromo-4-(difluoromethyl)pyridine-3,5-diol
CID 118999212
2-[4-(difluoromethyl)-5-hydroxy-2-(trifluoromethyl)-3-pyridinyl]acetonitrile
CID 118851080
6-amino-4-(difluoromethyl)-5-(trifluoromethoxy)pyridin-3-ol
CID 119014102

Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol?
The IUPAC name of 6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol (CID 119000260) is 6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol.
What is the SMILES notation for 6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol?
The canonical SMILES for 6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol is Oc1cnc(Cl)c(C(F)(F)F)c1C(F)F.
What is the InChIKey of 6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol?
The InChIKey is SQCYEUAJLJRRIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3ClF5NO/c8-5-4(7(11,12)13)3(6(9)10)2(15)1-14-5/h1,6,15H.
What are the key properties of 6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol?
6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol has a molecular weight of 247.55 g/mol, XLogP of 3.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol is sourced from PubChem (CID 119000260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).