Chemical ID: 6139866

CCOC(=O)c1c(cn(n1)c2cccc(c2)C(F)(F)F)O
Chemical ID:
6139866
Name [?]:
ethyl 4-hydroxy-1-[3-(trifluoromethyl)phenyl]-pyrazole-3-carboxylate
SMILES [?]:
CCOC(=O)c1c(cn(n1)c2cccc(c2)C(F)(F)F)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H11F3N2O3
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:7.89308
Area:470.677
Solvation:-3.87384
Coulombic:-60.3619
Bond Count [?]
All:22
Single:16
Double:6
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:300.233
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.71
LogP (Chemaxon):3.54

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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