UCSF

ZINC00105200

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) 3.72 3.28 -5.71 0 1 0 17 218.202 2

Vendor Notes

Note Type Comments Provided By
MP 102 - 105 Enamine Building Blocks
MP 102-105° Fluorochem
MP 102...105 Enamine Building Blocks
Mp [°C] 106 - 109 Acros Organics
Melting_Point 106-110? Alfa-Aesar
Melting_Point 106-110° Alfa-Aesar
MP 108 TCI
Boiling_Point 170-172?/10mm Alfa-Aesar
Boiling_Point 170-172°/10mm Alfa-Aesar
BP [°C] 200 Acros Organics
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% APIChem
Purity 99% Fluorochem
H phrase H335: May cause respiratory irritation Acros Organics
H phrase H335: May cause respiratory irritation; H319: Causes serious eye irritation; H315: Causes skin irritation Acros Organics
_Notes Intermediate for the manufacture of polyetheretherketone(PEEK) high performance polymer. Ask for reference. Apollo Scientific
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water Acros Organics
R phrase R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection. Acros Organics
Hazard XI: Irritant Acros Organics

Activity (Go SEA)

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