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

C6H3BrClF2NO — CID 130107825

IUPAC6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol
SMILESOc1cnc(Br)c(Cl)c1C(F)F
InChIInChI=1S/C6H3BrClF2NO/c7-5-4(8)3(6(9)10)2(12)1-11-5/h1,6,12H
InChIKeyVKUPYNIZBLIAJY-UHFFFAOYSA-N
MW258.45 g/mol
LogP3.14
Rot. Bonds1

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

6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol (PubChem CID 130107825) has the molecular formula C6H3BrClF2NO and a molecular weight of 258.45 g/mol. Its IUPAC name is 6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol.

Molecular Properties

Compound Name6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol
PubChem CID130107825
Molecular FormulaC6H3BrClF2NO
Molecular Weight258.45 g/mol
Exact Mass256.91
IUPAC Name6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol
SMILESOc1cnc(Br)c(Cl)c1C(F)F
InChIInChI=1S/C6H3BrClF2NO/c7-5-4(8)3(6(9)10)2(12)1-11-5/h1,6,12H
InChIKeyVKUPYNIZBLIAJY-UHFFFAOYSA-N
XLogP3.14
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.45
LogP ≤ 53.14
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

2-bromo-3,5-dichloro-4-(difluoromethyl)pyridine
CID 119019803
2-bromo-4-(difluoromethyl)pyridine-3,5-diol
CID 118999212
6-bromo-4-(chloromethyl)-5-(difluoromethyl)pyridin-3-ol
CID 119007028
6-bromo-5-chloro-4-(difluoromethyl)pyridine-3-carbonitrile
CID 130107758
6-(aminomethyl)-5-chloro-4-(difluoromethyl)pyridin-3-ol
CID 118825681
2-bromo-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonamide
CID 118995756
6-chloro-4-(difluoromethyl)-5-methylpyridin-3-ol
CID 119014799
2-bromo-3-chloro-5-(difluoromethyl)pyridine-4-carboxamide
CID 118999675
3-bromo-4-(difluoromethyl)-5-hydroxypyridine-2-carbonyl chloride
CID 130110573
6-bromo-4-chloro-5-(difluoromethyl)pyridine-3-sulfonamide
CID 119001281
6-chloro-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol
CID 119000260
2-bromo-4-chloro-5-(chloromethyl)-3-(difluoromethyl)pyridine
CID 119022825

Frequently Asked Questions

What is the IUPAC name of 6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol?
The IUPAC name of 6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol (CID 130107825) is 6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol.
What is the SMILES notation for 6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol?
The canonical SMILES for 6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol is Oc1cnc(Br)c(Cl)c1C(F)F.
What is the InChIKey of 6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol?
The InChIKey is VKUPYNIZBLIAJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3BrClF2NO/c7-5-4(8)3(6(9)10)2(12)1-11-5/h1,6,12H.
What are the key properties of 6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol?
6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol has a molecular weight of 258.45 g/mol, XLogP of 3.14, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-5-chloro-4-(difluoromethyl)pyridin-3-ol is sourced from PubChem (CID 130107825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).