UCSF

ZINC01679966

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Substance Information

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

Popular Name: Diethyl butylmalonate Diethyl butylmalonate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 133-08-4 , [133-08-4]

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) 3.10 4.04 -7 0 4 0 52 216.277 9 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 236-239? Alfa-Aesar
Boiling_Point 236-239° Alfa-Aesar
BP 240 TCI

Activity (Go SEA)

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