UCSF

ZINC01687074

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: Diethyl 2-ethyl-2-phenylmalonate Diethyl 2-ethyl-2-phenylmalonate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 76-67-5 , [76-67-5]

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) 3.33 4.34 -7.01 0 4 0 52 264.321 8 ↓

Vendor Notes

Note Type Comments Provided By
MP 7 TCI
BP 171 / 19 TCI
Boiling_Point 185?/15mm Alfa-Aesar
Boiling_Point 185°/15mm Alfa-Aesar
Purity 95% Fluorochem
Purity 98.5% APIChem

Activity (Go SEA)

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