UCSF

ZINC01666841

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 15 No

Popular Name: 2-Butylisoindoline-1,3-dione 2-Butylisoindoline-1,3-dione

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CAS Numbers: 1515-72-6 , [1515-72-6]

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) 2.96 6.3 -8.06 0 3 0 39 203.241 3 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 120-123?/5mm Alfa-Aesar
Boiling_Point 120-123°/5mm Alfa-Aesar
Melting_Point 32-35? Alfa-Aesar
Melting_Point 32-35° Alfa-Aesar
Purity 95% Fluorochem

Activity (Go SEA)

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