2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine

C9H4ClF2N3O — CID 13449

IUPAC2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine
SMILESFc1nc(F)nc(Oc2ccccc2Cl)n1
InChIInChI=1S/C9H4ClF2N3O/c10-5-3-1-2-4-6(5)16-9-14-7(11)13-8(12)15-9/h1-4H
InChIKeyZFJLOQARRCCGMD-UHFFFAOYSA-N
MW243.60 g/mol
LogP2.60
Rot. Bonds2

About 2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine

2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine (PubChem CID 13449) has the molecular formula C9H4ClF2N3O and a molecular weight of 243.60 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine
PubChem CID13449
Molecular FormulaC9H4ClF2N3O
Molecular Weight243.60 g/mol
Exact Mass243.00
IUPAC Name2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine
SMILESFc1nc(F)nc(Oc2ccccc2Cl)n1
InChIInChI=1S/C9H4ClF2N3O/c10-5-3-1-2-4-6(5)16-9-14-7(11)13-8(12)15-9/h1-4H
InChIKeyZFJLOQARRCCGMD-UHFFFAOYSA-N
XLogP2.60
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.60
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-Dichloro-6-(4-fluorophenoxy)-1,3,5-triazine
CID 2782796
2,4-Dichloro-6-phenoxy-1,3,5-triazine
CID 20807
2-(2-Chloro-4-fluorophenoxy)-4,6-bis(trichloromethyl)-1,3,5-triazine
CID 76312903
2,4-Dichloro-6-(3-fluorophenoxy)-1,3,5-triazine
CID 2782795
1,3,5-Triazine, 2,4,6-tris(2-chlorophenoxy)-
CID 11733242
2,4-Difluoro-6-phenoxy-1,3,5-triazine
CID 35624
2,4-Bis(4-chlorophenoxy)-6-fluoro-1,3,5-triazine
CID 53959698
2-Chloro-4-(2,4-dichlorophenoxy)-6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine
CID 54452123
2-(4-Chlorophenoxy)-4,6-difluoro-1,3,5-triazine
CID 70410708
2-Chloro-4-(2,4-dichlorophenoxy)-6-(1,1,1,2,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazine
CID 88644297
4-(2,6-Dichlorophenoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine
CID 122641810
4-(2-Chlorophenoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine
CID 122641820

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine?
The IUPAC name of 2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine (CID 13449) is 2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine.
What is the SMILES notation for 2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine?
The canonical SMILES for 2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine is Fc1nc(F)nc(Oc2ccccc2Cl)n1.
What is the InChIKey of 2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine?
The InChIKey is ZFJLOQARRCCGMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H4ClF2N3O/c10-5-3-1-2-4-6(5)16-9-14-7(11)13-8(12)15-9/h1-4H.
What are the key properties of 2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine?
2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine has a molecular weight of 243.60 g/mol, XLogP of 2.60, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-4,6-difluoro-1,3,5-triazine is sourced from PubChem (CID 13449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).