5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole

C10H5Cl2F3N2 — CID 66022575

IUPAC5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole
SMILESFC(F)(F)c1cc(Cl)n(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C10H5Cl2F3N2/c11-6-1-3-7(4-2-6)17-9(12)5-8(16-17)10(13,14)15/h1-5H
InChIKeyYADIYETVQXTVQM-UHFFFAOYSA-N
MW281.06 g/mol
LogP4.20
Rot. Bonds1

About 5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole

5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole (PubChem CID 66022575) has the molecular formula C10H5Cl2F3N2 and a molecular weight of 281.06 g/mol. Its IUPAC name is 5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole.

Molecular Properties

Compound Name5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole
PubChem CID66022575
Molecular FormulaC10H5Cl2F3N2
Molecular Weight281.06 g/mol
Exact Mass279.98
IUPAC Name5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole
SMILESFC(F)(F)c1cc(Cl)n(-c2ccc(Cl)cc2)n1
InChIInChI=1S/C10H5Cl2F3N2/c11-6-1-3-7(4-2-6)17-9(12)5-8(16-17)10(13,14)15/h1-5H
InChIKeyYADIYETVQXTVQM-UHFFFAOYSA-N
XLogP4.20
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.06
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3,5-Bis(trifluoromethyl)-1H-pyrazol-1-yl)aniline
CID 2740668
1,5-Bis-(4-chloro-phenyl)-3-trifluoromethyl-1H-pyrazole
CID 10021211
5-chloro-4-(chloromethyl)-3-methyl-1-phenyl-1H-pyrazole
CID 4962775
1-(3,4-Dichlorophenyl)-3,5-dimethylpyrazole
CID 1072358
1-(4-chlorophenyl)-1H-pyrazole
CID 12238132
5-Chloro-3-methyl-1-phenyl-1H-pyrazole
CID 2735771
3-Methyl-1-phenyl-5-(trifluoromethyl)-1H-pyrazole
CID 14668995
1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole
CID 21724113
Pyrazole, 5-chloro-4-(dimethylamino)-4-methyl-1-phenyl-
CID 210806
5-chloro-3-methyl-1-phenyl-1H-pyrazole-4-carbonitrile
CID 2748811
4,5-Dichloro-3-(dichloromethyl)-1-phenylpyrazole
CID 4372988
4-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)aniline
CID 19616586

Frequently Asked Questions

What is the IUPAC name of 5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole?
The IUPAC name of 5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole (CID 66022575) is 5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole.
What is the SMILES notation for 5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole?
The canonical SMILES for 5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole is FC(F)(F)c1cc(Cl)n(-c2ccc(Cl)cc2)n1.
What is the InChIKey of 5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole?
The InChIKey is YADIYETVQXTVQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Cl2F3N2/c11-6-1-3-7(4-2-6)17-9(12)5-8(16-17)10(13,14)15/h1-5H.
What are the key properties of 5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole?
5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole has a molecular weight of 281.06 g/mol, XLogP of 4.20, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-1-(4-chlorophenyl)-3-(trifluoromethyl)pyrazole is sourced from PubChem (CID 66022575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).