UCSF

ZINC01673031

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 13 Yes

Popular Name: Ethyl 4-methoxybenzoate Ethyl 4-methoxybenzoate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 27914-53-0 , 94-30-4 , [94-30-4]

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) 2.54 2.34 -6.2 0 3 0 35 180.203 4 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 263? Alfa-Aesar
Boiling_Point 263° Alfa-Aesar
MP 7-8 °C(lit.) Indofine
Melting_Point 7-8? Alfa-Aesar
Melting_Point 7-8° Alfa-Aesar
Purity 95% Fluorochem

Activity (Go SEA)

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