UCSF

ZINC01634150

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 17 Yes

Popular Name: Ethyl 3,4,5-trimethoxybenzoate Ethyl 3,4,5-trimethoxybenzoate

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CAS Number: 6178-44-5

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) 2.12 3.1 -7.84 0 5 0 54 240.255 6 ↓

Vendor Notes

Note Type Comments Provided By
BP 168 / 6 TCI
MP 54 TCI
Purity 95% Fluorochem
Purity 97% APIChem

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