UCSF

ZINC00164563

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 14 Yes

Popular Name: 3,4,5-Trimethoxybenzyl alcohol 3,4,5-Trimethoxybenzyl alcohol

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CAS Numbers: 3840-31-1 , [301-00-8] , [3840-31-1] , [3840-38-1]

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) 0.91 0.94 -9.9 1 4 0 48 198.218 4 ↓

Vendor Notes

Note Type Comments Provided By
BP 137-140°/0.4mm Fluorochem
BP 155 / 1 TCI
Boiling_Point 228?/25mm Alfa-Aesar
Boiling_Point 228°/25mm Alfa-Aesar
Purity 97% Fluorochem
Purity 98% APIChem

Activity (Go SEA)

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