UCSF

ZINC00388430

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) 2.15 2.37 -7.56 0 4 0 44 196.202 4

Vendor Notes

Note Type Comments Provided By
BP [°C] 298 Acros Organics
Boiling_Point 298? Alfa-Aesar
Boiling_Point 298° Alfa-Aesar
Melting_Point 40-43? Alfa-Aesar
Melting_Point 40-43° Alfa-Aesar
Mp [°C] 41 - 43 Acros Organics
MP 42 - 43 Enamine Building Blocks
MP 42-43 °C(lit.) Indofine
MP 42-43° Oakwood Chemical
MP 42...43 Enamine Building Blocks
MP 44-45o C Indofine
MP 45 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 98% Fluorochem
Purity 99% APIChem
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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