UCSF

ZINC01760831

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 16 Yes

Popular Name: Dibenzosuberenone Dibenzosuberenone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2222-33-5 , 98977-36-7 , [2222-33-5]

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) 4.30 8.71 -8.82 0 1 0 17 206.244 0 ↓

Vendor Notes

Note Type Comments Provided By
BP 210 / 3 TCI
Mp [°C] 85 - 91 Acros Organics
MP 85-91° Fluorochem
Melting_Point 88-89? Alfa-Aesar
Melting_Point 88-89° Alfa-Aesar
MP 89 TCI
Purity 97% Fluorochem
Purity 98% APIChem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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