UCSF

ZINC00170148

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 12 No

Popular Name: 5-Bromo-2,4-difluoronitrobenzene 5-Bromo-2,4-difluoronitrobenzene

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CAS Numbers: 345-24-4 , [345-24-4]

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) 2.89 2.34 -4.3 0 3 0 46 237.987 1 ↓

Vendor Notes

Note Type Comments Provided By
BP 85°/0.4mm Matrix Scientific
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
BP 97°/5mm Oakwood Chemical
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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

No pre-computed analogs available. Try a structural similarity search.