6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol

C6H3ClF3NO — CID 118998226

IUPAC6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol
SMILESOc1cnc(Cl)c(C(F)F)c1F
InChIInChI=1S/C6H3ClF3NO/c7-5-3(6(9)10)4(8)2(12)1-11-5/h1,6,12H
InChIKeyQWGYEZQGFXZHHY-UHFFFAOYSA-N
MW197.54 g/mol
LogP2.52
Rot. Bonds1

About 6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol

6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol (PubChem CID 118998226) has the molecular formula C6H3ClF3NO and a molecular weight of 197.54 g/mol. Its IUPAC name is 6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol.

Molecular Properties

Compound Name6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol
PubChem CID118998226
Molecular FormulaC6H3ClF3NO
Molecular Weight197.54 g/mol
Exact Mass196.99
IUPAC Name6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol
SMILESOc1cnc(Cl)c(C(F)F)c1F
InChIInChI=1S/C6H3ClF3NO/c7-5-3(6(9)10)4(8)2(12)1-11-5/h1,6,12H
InChIKeyQWGYEZQGFXZHHY-UHFFFAOYSA-N
XLogP2.52
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.54
LogP ≤ 52.52
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

5-(difluoromethyl)-4,6-difluoropyridin-3-ol
CID 130099609
6-chloro-4-(difluoromethyl)-5-methylpyridin-3-ol
CID 119014799
6-chloro-5-(difluoromethyl)-4-methoxypyridin-3-ol
CID 119013301
5-(difluoromethyl)-4-fluoro-6-(hydroxymethyl)pyridin-3-ol
CID 130079587
2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide
CID 130072896
6-(bromomethyl)-5-(difluoromethyl)-4-fluoropyridin-3-ol
CID 130079407
6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol
CID 119000260
2-chloro-3-(difluoromethyl)-4-fluoro-5-methoxypyridine
CID 119010666
3-(difluoromethyl)-4-fluoro-5-hydroxypyridine-2-carbaldehyde
CID 130079623
2-chloro-4-(difluoromethyl)-3,5-difluoropyridine
CID 130099578
6-chloro-4-(difluoromethyl)-5-fluoropyridine-3-carbonyl chloride
CID 130072079
6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol
CID 130107825

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol?
The IUPAC name of 6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol (CID 118998226) is 6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol.
What is the SMILES notation for 6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol?
The canonical SMILES for 6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol is Oc1cnc(Cl)c(C(F)F)c1F.
What is the InChIKey of 6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol?
The InChIKey is QWGYEZQGFXZHHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3ClF3NO/c7-5-3(6(9)10)4(8)2(12)1-11-5/h1,6,12H.
What are the key properties of 6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol?
6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol has a molecular weight of 197.54 g/mol, XLogP of 2.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol is sourced from PubChem (CID 118998226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).