UCSF

ZINC01081231

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) 5.01 1.06 -6.5 0 0 0 0 212.317 0

Vendor Notes

Note Type Comments Provided By
Mp [°C] 147 - 153 Acros Organics
Melting_Point 153-157? Alfa-Aesar
Melting_Point 153-157° Alfa-Aesar
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
H phrase H302: Harmful if swallowed Acros Organics
Warnings IRRITANT Matrix Scientific
P phrase P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell Acros Organics
R phrase R22: Harmful if swallowed. Acros Organics
Hazard XN: Harmful Acros Organics

Activity (Go SEA)

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