UCSF

ZINC02556476

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 10 Yes

Popular Name: 2-Methyl-4,4,4-trifluorobutyric acid 2-Methyl-4,4,4-trifluorobutyric …

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CAS Numbers: 99783-23-0 , [99783-23-0]

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) 1.50 3.57 -40.15 0 2 -1 40 155.095 3 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 172-175? Alfa-Aesar
Boiling_Point 172-175° Alfa-Aesar
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings CORROSIVE Matrix Scientific

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

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