UCSF

ZINC01577443

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 11 Yes

Popular Name: 2-(sec-Butyl)cyclohexanone 2-(sec-Butyl)cyclohexanone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 14765-30-1 , [14765-30-1]

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 1.89 -3.9 0 1 0 17 154.253 2 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 76-78?/8mm Alfa-Aesar
Boiling_Point 76-78°/8mm Alfa-Aesar
BP 78 / 8 TCI
Purity 95% Fluorochem

Activity (Go SEA)

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