UCSF

ZINC12359219

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 11 Yes

Popular Name: 2,4-Dichloro-5-fluorobenzonitrile 2,4-Dichloro-5-fluorobenzonitrile

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CAS Number: 128593-93-1

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) 3.07 2.94 -3.62 0 1 0 24 190.004 0 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 44-47? Alfa-Aesar
Melting_Point 44-47° Alfa-Aesar
Purity 95% Fluorochem

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