UCSF

ZINC01672809

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) 4.34 8.39 -4.67 0 2 0 26 186.295 9

Vendor Notes

Note Type Comments Provided By
Mp [°C] 18 Acros Organics
Melting_Point 18? Alfa-Aesar
Melting_Point 18° Alfa-Aesar
Boiling_Point 223-225? Alfa-Aesar
Boiling_Point 223-225° Alfa-Aesar
BP [°C] 226 Acros Organics
H phrase H302: Harmful if swallowed Acros Organics
H phrase H411: Toxic to aquatic life with long lasting effects Acros Organics
P phrase P273: Avoid release to the environment Acros Organics
P phrase P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell Acros Organics
R phrase R38: Irritating to skin. Acros Organics
S phrase S37: Wear suitable gloves. Acros Organics
Hazard XI: Irritant Acros Organics

Activity (Go SEA)

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