UCSF

ZINC01555526

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) 5.86 13.3 -12.15 0 4 0 45 368.369 6

Vendor Notes

Note Type Comments Provided By
Mp [°C] 25 Acros Organics
Boiling_Point 265?/10mm Alfa-Aesar
Boiling_Point 265°/10mm Alfa-Aesar
BP [°C] 410 Acros Organics
Purity 98% Fluorochem
H phrase H411: Toxic to aquatic life with long lasting effects Acros Organics
H phrase H411: Toxic to aquatic life with long lasting effects; H370: Causes damage to organs Acros Organics
P phrase P307 + P311: IF exposed: Call a POISON CENTER or doctor/physician Acros Organics
P phrase P307 + P311: IF exposed: Call a POISON CENTER or doctor/physician; P273: Avoid release to the environment; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell Acros Organics
R phrase R39/23/24/25: Toxic : danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed. Acros Organics
R phrase R39/23/24/25: Toxic : danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed.; R51/53: Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. Acros Organics
S phrase S20/21: When using do not eat, drink or smoke. Acros Organics
S phrase S20/21: When using do not eat, drink or smoke.; S28A: After contact with skin, wash immediately with plenty of water.; S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label where possible).; S61: Avoid release to Acros Organics
Hazard T: Toxic Acros Organics
Hazard T: Toxic; N: Dangerous for the environment Acros Organics

Activity (Go SEA)

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