UCSF

ZINC00156199

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 12 Yes

Popular Name: 3',5'-Dichloro-2'-hydroxyacetophenone 3',5'-Dichloro-2'-hydroxyacetoph…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 3321-92-4 , [3321-92-4]

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) 2.83 0.26 -6.42 1 2 0 37 205.04 1 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 132-134?/18mm Alfa-Aesar
Boiling_Point 132-134°/18mm Alfa-Aesar
MP 94-97° Oakwood Chemical
Melting_Point 95-98? Alfa-Aesar
Melting_Point 95-98° Alfa-Aesar
Purity 99% Fluorochem

Activity (Go SEA)

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