UCSF

ZINC00154127

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 14 Yes

Popular Name: 5-Fluoro-2-(methylsulfonyl)benzoic acid 5-Fluoro-2-(methylsulfonyl)benzo…

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CAS Numbers: 773873-55-5 , [773873-55-5]

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) 0.91 2.15 -47.3 0 4 -1 74 217.197 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 147-149° Matrix Scientific
MP 151-153° Oakwood Chemical
Purity 95%+ Fluorochem
Warnings Irritant Matrix Scientific

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