UCSF

ZINC02567956

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) 3.67 2.26 -7.87 0 3 0 45 199.209 2

Vendor Notes

Note Type Comments Provided By
BP 204 / 12 TCI
BP [°C] 227 (p=35 torr) Acros Organics
Boiling_Point 227?/35mm Alfa-Aesar
Boiling_Point 227°/35mm Alfa-Aesar
Mp [°C] 56 - 60 Acros Organics
Melting_Point 58-60? Alfa-Aesar
Melting_Point 58-60° Alfa-Aesar
MP 61 TCI
H phrase H302: Harmful if swallowed Acros Organics
H phrase H302: Harmful if swallowed; H341: Suspected of causing genetic defects Acros Organics
P phrase P281: Use personal protective equipment as required Acros Organics
P phrase P281: Use personal protective equipment as required; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P260: Do not breathe dust/fume/gas/mist/vapors/spray Acros Organics
R phrase R22: Harmful if swallowed. Acros Organics
R phrase R22: Harmful if swallowed.; R68: Possible risks of irreversible effects. Acros Organics
S phrase S36/37: Wear suitable protective clothing and gloves. Acros Organics
Hazard XN: Harmful Acros Organics

Activity (Go SEA)

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