6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde

C12H6Cl2FNO — CID 133090737

IUPAC6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde
SMILESO=Cc1ccc(-c2cccc(Cl)c2Cl)nc1F
InChIInChI=1S/C12H6Cl2FNO/c13-9-3-1-2-8(11(9)14)10-5-4-7(6-17)12(15)16-10/h1-6H
InChIKeyXQOXGKIRHJNNCP-UHFFFAOYSA-N
MW270.09 g/mol
LogP4.01
Rot. Bonds2

About 6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde

6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde (PubChem CID 133090737) has the molecular formula C12H6Cl2FNO and a molecular weight of 270.09 g/mol. Its IUPAC name is 6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde.

Molecular Properties

Compound Name6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde
PubChem CID133090737
Molecular FormulaC12H6Cl2FNO
Molecular Weight270.09 g/mol
Exact Mass268.98
IUPAC Name6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde
SMILESO=Cc1ccc(-c2cccc(Cl)c2Cl)nc1F
InChIInChI=1S/C12H6Cl2FNO/c13-9-3-1-2-8(11(9)14)10-5-4-7(6-17)12(15)16-10/h1-6H
InChIKeyXQOXGKIRHJNNCP-UHFFFAOYSA-N
XLogP4.01
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.09
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-fluoro-6-(3,4,5-trichlorophenyl)pyridine-3-carbaldehyde
CID 133090274
2-fluoro-6-(2,4,6-trichlorophenyl)pyridine-3-carbaldehyde
CID 133090273
6-(2,3-dichlorophenyl)pyridine-3-carbaldehyde
CID 24730313
2-fluoro-6-pyridin-4-ylpyridine-3-carbaldehyde
CID 131869660
6-(2-chlorophenyl)-2-methoxypyridine-3-carbaldehyde
CID 175347635
5-(2,3-dichlorophenyl)-6-fluoropyridine-3-carbaldehyde
CID 133090767
2-fluoro-6-pyridin-3-ylpyridine-3-carbaldehyde
CID 131869800
2-fluoro-3-(2,3,4,5,6-pentachlorophenyl)benzaldehyde
CID 134620169
2-(2,3-dichlorophenyl)-5-methylpyridine-3-carbaldehyde
CID 118841863
2-(2,3-dichlorophenyl)-6-fluoropyridine-4-carboxylic acid
CID 118847536
2-(3-chloro-2-fluorophenyl)-5-fluoropyridine-4-carbaldehyde
CID 172868911
5-(2,3-dichlorophenyl)-3-fluoropyridine-2-carbaldehyde
CID 133091105

Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde?
The IUPAC name of 6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde (CID 133090737) is 6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde.
What is the SMILES notation for 6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde?
The canonical SMILES for 6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde is O=Cc1ccc(-c2cccc(Cl)c2Cl)nc1F.
What is the InChIKey of 6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde?
The InChIKey is XQOXGKIRHJNNCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl2FNO/c13-9-3-1-2-8(11(9)14)10-5-4-7(6-17)12(15)16-10/h1-6H.
What are the key properties of 6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde?
6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde has a molecular weight of 270.09 g/mol, XLogP of 4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,3-dichlorophenyl)-2-fluoropyridine-3-carbaldehyde is sourced from PubChem (CID 133090737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).