UCSF

ZINC02528695

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Substance Information

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

Popular Name: 3,3,4,4,4-Pentafluoro-2-hydroxy-2-methylbutyricacid methyl ester 3,3,4,4,4-Pentafluoro-2-hydroxy-…

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CAS Number: 723294-73-3

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) 1.54 2.09 -5.14 1 3 0 47 222.109 4 ↓

Vendor Notes

Note Type Comments Provided By
BP 147° Oakwood Chemical

Activity (Go SEA)

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