UCSF

ZINC00159089

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 11 No

Popular Name: 2-Bromo-1-indanone 2-Bromo-1-indanone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1175-27-5 , 1775-27-5 , [1775-27-5]

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) 2.18 0.27 -6.63 0 1 0 17 211.058 0 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 110-112?/0.4mm Alfa-Aesar
Boiling_Point 110-112°/0.4mm Alfa-Aesar
Melting_Point 37-39? Alfa-Aesar
Melting_Point 37-39° Alfa-Aesar
Purity 97% Fluorochem

Activity (Go SEA)

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