5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol

C11H5Cl4NO — CID 133092526

IUPAC5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol
SMILESOc1cnc(-c2c(Cl)ccc(Cl)c2Cl)c(Cl)c1
InChIInChI=1S/C11H5Cl4NO/c12-6-1-2-7(13)10(15)9(6)11-8(14)3-5(17)4-16-11/h1-4,17H
InChIKeyVRNBOFWMGMGRTK-UHFFFAOYSA-N
MW308.98 g/mol
LogP5.07
Rot. Bonds1

About 5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol

5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol (PubChem CID 133092526) has the molecular formula C11H5Cl4NO and a molecular weight of 308.98 g/mol. Its IUPAC name is 5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol.

Molecular Properties

Compound Name5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol
PubChem CID133092526
Molecular FormulaC11H5Cl4NO
Molecular Weight308.98 g/mol
Exact Mass306.91
IUPAC Name5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol
SMILESOc1cnc(-c2c(Cl)ccc(Cl)c2Cl)c(Cl)c1
InChIInChI=1S/C11H5Cl4NO/c12-6-1-2-7(13)10(15)9(6)11-8(14)3-5(17)4-16-11/h1-4,17H
InChIKeyVRNBOFWMGMGRTK-UHFFFAOYSA-N
XLogP5.07
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.98
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze 5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(2,3,6-trichlorophenyl)pyridin-3-ol
CID 133092618
5-(2,3,6-trichlorophenyl)pyridin-3-ol
CID 130088550
5-chloro-2,3-bis(2,3,6-trichlorophenyl)pyridine
CID 134637033
2-(2,3,6-trichlorophenyl)-5-(trifluoromethyl)pyridin-3-ol
CID 133092660
[5,6-bis(2,3,6-trichlorophenyl)-3-pyridinyl]methanol
CID 134637224
5-fluoro-2,3-bis(2,3,6-trichlorophenyl)pyridine
CID 134637089
5-amino-6-(2,3,6-trichlorophenyl)pyridine-3-carbonitrile
CID 134637003
methyl 5-fluoro-2-(2,3,6-trichlorophenyl)pyridine-3-carboxylate
CID 133090466
4-(5-amino-3-chloro-2-pyridinyl)phenol
CID 136758122
6-chloro-5-(3,4-dichlorophenyl)pyridin-3-ol
CID 119002730
5,8-dichloroquinolin-3-ol
CID 106989834
bis(3,4-dichlorophenol);zirconium
CID 161397670

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol?
The IUPAC name of 5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol (CID 133092526) is 5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol.
What is the SMILES notation for 5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol?
The canonical SMILES for 5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol is Oc1cnc(-c2c(Cl)ccc(Cl)c2Cl)c(Cl)c1.
What is the InChIKey of 5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol?
The InChIKey is VRNBOFWMGMGRTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl4NO/c12-6-1-2-7(13)10(15)9(6)11-8(14)3-5(17)4-16-11/h1-4,17H.
What are the key properties of 5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol?
5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol has a molecular weight of 308.98 g/mol, XLogP of 5.07, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(2,3,6-trichlorophenyl)pyridin-3-ol is sourced from PubChem (CID 133092526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).