3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde

C12H6Cl2FNO — CID 133090824

IUPAC3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde
SMILESO=Cc1c(F)cncc1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C12H6Cl2FNO/c13-7-1-2-8(11(14)3-7)9-4-16-5-12(15)10(9)6-17/h1-6H
InChIKeyUKEANZAFHAKNKO-UHFFFAOYSA-N
MW270.09 g/mol
LogP4.01
Rot. Bonds2

About 3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde

3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde (PubChem CID 133090824) has the molecular formula C12H6Cl2FNO and a molecular weight of 270.09 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde
PubChem CID133090824
Molecular FormulaC12H6Cl2FNO
Molecular Weight270.09 g/mol
Exact Mass268.98
IUPAC Name3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde
SMILESO=Cc1c(F)cncc1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C12H6Cl2FNO/c13-7-1-2-8(11(14)3-7)9-4-16-5-12(15)10(9)6-17/h1-6H
InChIKeyUKEANZAFHAKNKO-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': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

3-(3,5-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde
CID 133090689
2-(2,4-dichlorophenyl)-4-(trifluoromethyl)pyridine-3-carbaldehyde
CID 118802444
2-chloro-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde
CID 119008873
3-chloro-5-(2,3,4-trichlorophenyl)pyridine-4-carbaldehyde
CID 134635841
N-[5-(2,4-dichlorophenyl)-1,7-naphthyridin-3-yl]formamide
CID 174888346
2-amino-5-(2,4-dichlorophenyl)pyridine-4-carbaldehyde
CID 118996981
[3-chloro-5-(2,4-dichlorophenyl)-4-pyridinyl]methanol
CID 133088589
3-(5-chloro-2-fluorophenyl)pyridine-4-carbaldehyde
CID 169447869
3-(2,4-dichlorophenyl)-2,5-difluoropyridine
CID 133090808
3,5-bis(2,3-difluorophenyl)pyridine-4-carbaldehyde
CID 133093641
3-(2,4-dichlorophenyl)-4-fluoro-2-hydroxybenzaldehyde
CID 86608680
3,5-dichloropyridine-4-carbaldehyde
CID 2762988

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde?
The IUPAC name of 3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde (CID 133090824) is 3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde?
The canonical SMILES for 3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde is O=Cc1c(F)cncc1-c1ccc(Cl)cc1Cl.
What is the InChIKey of 3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde?
The InChIKey is UKEANZAFHAKNKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl2FNO/c13-7-1-2-8(11(14)3-7)9-4-16-5-12(15)10(9)6-17/h1-6H.
What are the key properties of 3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde?
3-(2,4-dichlorophenyl)-5-fluoropyridine-4-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 3-(2,4-dichlorophenyl)-5-fluoropyridine-4-carbaldehyde is sourced from PubChem (CID 133090824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).