UCSF

ZINC02560220

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 14 Yes

Popular Name: 2-(Trifluoromethoxy)phenylacetonitrile 2-(Trifluoromethoxy)phenylaceton…

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CAS Numbers: 108307-56-8 , 137218-25-8 , [137218-25-8]

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) 2.82 4.37 -8.24 0 2 0 33 201.147 3 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 222-223? Alfa-Aesar
Boiling_Point 222-223° Alfa-Aesar
Purity 98% Fluorochem
Warnings TOXIC Matrix Scientific

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