2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine

C9H3Cl3FN3 — CID 115504981

IUPAC2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine
SMILESFc1ccc(-c2nc(Cl)nc(Cl)n2)c(Cl)c1
InChIInChI=1S/C9H3Cl3FN3/c10-6-3-4(13)1-2-5(6)7-14-8(11)16-9(12)15-7/h1-3H
InChIKeyFJPIRCCSIGXDNL-UHFFFAOYSA-N
MW278.50 g/mol
LogP3.64
Rot. Bonds1

About 2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine

2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine (PubChem CID 115504981) has the molecular formula C9H3Cl3FN3 and a molecular weight of 278.50 g/mol. Its IUPAC name is 2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine
PubChem CID115504981
Molecular FormulaC9H3Cl3FN3
Molecular Weight278.50 g/mol
Exact Mass276.94
IUPAC Name2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine
SMILESFc1ccc(-c2nc(Cl)nc(Cl)n2)c(Cl)c1
InChIInChI=1S/C9H3Cl3FN3/c10-6-3-4(13)1-2-5(6)7-14-8(11)16-9(12)15-7/h1-3H
InChIKeyFJPIRCCSIGXDNL-UHFFFAOYSA-N
XLogP3.64
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.50
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-3-(2-chloro-4-fluorophenyl)-1,2,4-oxadiazole
CID 62944891
4-tert-butyl-6-chloro-2-(2-chloro-4-fluorophenyl)pyrimidine
CID 62946502
1-[2-(2-chloro-4-fluorophenyl)-4,6-dimethylpyrimidin-5-yl]-N-methylmethanamine
CID 62944595
4-chloro-2-(2-chloro-4-fluorophenyl)-5-ethyl-6-methylpyrimidine
CID 62944331
4-chloro-2-(2-chloro-4-fluorophenyl)-6-(methoxymethyl)pyrimidine
CID 62944668
2-(2-chloro-4-fluorophenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 62944582
5-bromo-6-tert-butyl-2-(2-chloro-4-fluorophenyl)pyrimidin-4-amine
CID 66306206
4-chloro-2-(2-chloro-4-fluorophenyl)-6-methylthieno[2,3-d]pyrimidine
CID 55247605
2-(2-chloro-4-fluorophenyl)-4-methyl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114740085
[6-tert-butyl-2-(2-chloro-4-fluorophenyl)pyrimidin-4-yl]hydrazine
CID 62944421
N-[[2-(2-chloro-4-fluorophenyl)-4,6-dimethylpyrimidin-5-yl]methyl]propan-2-amine
CID 62944754
[2-(2-chloro-4-fluorophenyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62946048

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine?
The IUPAC name of 2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine (CID 115504981) is 2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine.
What is the SMILES notation for 2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine?
The canonical SMILES for 2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine is Fc1ccc(-c2nc(Cl)nc(Cl)n2)c(Cl)c1.
What is the InChIKey of 2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine?
The InChIKey is FJPIRCCSIGXDNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H3Cl3FN3/c10-6-3-4(13)1-2-5(6)7-14-8(11)16-9(12)15-7/h1-3H.
What are the key properties of 2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine?
2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine has a molecular weight of 278.50 g/mol, XLogP of 3.64, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-(2-chloro-4-fluorophenyl)-1,3,5-triazine is sourced from PubChem (CID 115504981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).