UCSF

ZINC00395891

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 16 No

Popular Name: 3-(3,4-Difluorophenyl)-3-oxo-propionic acid ethyl ester 3-(3,4-Difluorophenyl)-3-oxo-pro…

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CAS Number: 252955-07-0

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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) 1.92 7.77 -16.35 0 3 0 43 228.194 5 ↓

Vendor Notes

Note Type Comments Provided By
BP 89°/0.4mm Oakwood Chemical

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