UCSF

ZINC01648326

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 19 No

Popular Name: Diethyl dibutylmalonate Diethyl dibutylmalonate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 596-75-8 , [596-75-8]

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) 4.75 4.49 -5.19 0 4 0 52 272.385 12 ↓

Vendor Notes

Note Type Comments Provided By
BP 142 / 8 TCI
Boiling_Point 150?/12mm Alfa-Aesar
Boiling_Point 150°/12mm Alfa-Aesar

Activity (Go SEA)

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