UCSF

ZINC00146326

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 11 Yes

Popular Name: 1-(4-fluorophenyl)-2-hydroxy-1-ethanone 1-(4-fluorophenyl)-2-hydroxy-1-e…

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CAS Numbers: 403-31-6 , [403-31-6]

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) 0.99 2.93 -10.57 1 2 0 37 154.14 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 113 - 117 KeyOrganics
MP 113-117° Matrix Scientific
Purity 95% Fluorochem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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