UCSF

ZINC01081250

Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2004 16 No

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Vendors

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) 3.35 1.79 -10.43 0 2 0 26 212.248 4

Vendor Notes

Note Type Comments Provided By
Boiling_Point 180?/0.08mm Alfa-Aesar
Boiling_Point 180°/0.08mm Alfa-Aesar
Melting_Point 54-58? Alfa-Aesar
Melting_Point 54-58° Alfa-Aesar
MP 55 - 57 Enamine Building Blocks
Mp [°C] 55 - 59 Acros Organics
MP 55...57 Enamine Building Blocks
MP 57 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
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% )