UCSF

ZINC02378825

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 16 Yes

Popular Name: Ethyl 4-(4-fluorophenyl)-4-oxobutyrate Ethyl 4-(4-fluorophenyl)-4-oxobu…

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CAS Numbers: 41310-80-9 , [41310-80-9]

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) 2.10 3.39 -6.54 0 3 0 43 224.231 6 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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