UCSF

ZINC00337544

Annotations

Vendors

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) 2.19 3.82 -6.2 1 2 0 25 147.177 1

Vendor Notes

Note Type Comments Provided By
Boiling_Point 105?/0.2mm Alfa-Aesar
BP 105°/0.2mm Matrix Scientific
melting_point 90 - 92 KeyOrganics
Mp [°C] 90 - 94 Acros Organics
Melting_Point 90-94? Alfa-Aesar
MP 90-94° Matrix Scientific
MP 93 TCI
Purity 95% Fluorochem
Purity 98% Matrix Scientific
Warnings IRRITANT, LIGHT SENSITIVE Matrix Scientific
Warnings Irritant/Light Sensitive Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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