UCSF

ZINC30678566

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 1st, 2009 14 Yes

Popular Name: Ethyl 2-(trifluoromethyl)thiazole-5-carboxylate Ethyl 2-(trifluoromethyl)thiazol…

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CAS Numbers: 131748-96-4 , [131748-96-4]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.94 4.54 -4.12 0 3 0 39 225.191 4 ↓

Vendor Notes

Note Type Comments Provided By
BP 195° Matrix Scientific
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.