UCSF

ZINC00409176

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 12 Yes

Popular Name: Methyl 2-methoxybenzoate Methyl 2-methoxybenzoate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 606-45-1 , [606-45-1]

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) 2.20 2.82 -9.3 0 3 0 36 166.176 3 ↓

Vendor Notes

Note Type Comments Provided By
BP 228 TCI
Boiling_Point 246-248? Alfa-Aesar
MP 246-248o C Indofine
Boiling_Point 246-248° Alfa-Aesar
Purity 95% Fluorochem
SOLUBILITY Soluble in Chloroofrm Indofine

Activity (Go SEA)

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