4,6-dichloro-2-methylpyridin-3-ol;ethane

C8H11Cl2NO — CID 142310785

IUPAC4,6-dichloro-2-methylpyridin-3-ol;ethane
SMILESCC.Cc1nc(Cl)cc(Cl)c1O
InChIInChI=1S/C6H5Cl2NO.C2H6/c1-3-6(10)4(7)2-5(8)9-3;1-2/h2,10H,1H3;1-2H3
InChIKeyFOCSWCQSDOGCQV-UHFFFAOYSA-N
MW208.09 g/mol
LogP3.43
Rot. Bonds

About 4,6-dichloro-2-methylpyridin-3-ol;ethane

4,6-dichloro-2-methylpyridin-3-ol;ethane (PubChem CID 142310785) has the molecular formula C8H11Cl2NO and a molecular weight of 208.09 g/mol. Its IUPAC name is 4,6-dichloro-2-methylpyridin-3-ol;ethane.

Molecular Properties

Compound Name4,6-dichloro-2-methylpyridin-3-ol;ethane
PubChem CID142310785
Molecular FormulaC8H11Cl2NO
Molecular Weight208.09 g/mol
Exact Mass207.02
IUPAC Name4,6-dichloro-2-methylpyridin-3-ol;ethane
SMILESCC.Cc1nc(Cl)cc(Cl)c1O
InChIInChI=1S/C6H5Cl2NO.C2H6/c1-3-6(10)4(7)2-5(8)9-3;1-2/h2,10H,1H3;1-2H3
InChIKeyFOCSWCQSDOGCQV-UHFFFAOYSA-N
XLogP3.43
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.09
LogP ≤ 53.43
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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Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-2-methylpyridin-3-ol;ethane?
The IUPAC name of 4,6-dichloro-2-methylpyridin-3-ol;ethane (CID 142310785) is 4,6-dichloro-2-methylpyridin-3-ol;ethane.
What is the SMILES notation for 4,6-dichloro-2-methylpyridin-3-ol;ethane?
The canonical SMILES for 4,6-dichloro-2-methylpyridin-3-ol;ethane is CC.Cc1nc(Cl)cc(Cl)c1O.
What is the InChIKey of 4,6-dichloro-2-methylpyridin-3-ol;ethane?
The InChIKey is FOCSWCQSDOGCQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Cl2NO.C2H6/c1-3-6(10)4(7)2-5(8)9-3;1-2/h2,10H,1H3;1-2H3.
What are the key properties of 4,6-dichloro-2-methylpyridin-3-ol;ethane?
4,6-dichloro-2-methylpyridin-3-ol;ethane has a molecular weight of 208.09 g/mol, XLogP of 3.43, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-2-methylpyridin-3-ol;ethane is sourced from PubChem (CID 142310785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).