UCSF

ZINC01624985

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) 1.49 1.98 -11.16 0 4 0 56 228.269 4

Vendor Notes

Note Type Comments Provided By
Mp [°C] 45 - 48 Acros Organics
Melting_Point 46-49? Alfa-Aesar
Melting_Point 46-49° Alfa-Aesar
MP 48 TCI
Purity 95% Fluorochem
Purity 99% Fluorochem
H phrase H317: May cause an allergic skin reaction Acros Organics
H phrase H317: May cause an allergic skin reaction; H411: Toxic to aquatic life with long lasting effects; H318: Causes serious eye damage; H341: Suspected of causing genetic defects; H350: May cause cancer Acros Organics
H phrase H351: Suspected of causing cancer Acros Organics
H phrase H351: Suspected of causing cancer; H317: May cause an allergic skin reaction; H318: Causes serious eye damage Acros Organics
P phrase P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing Acros Organics
P phrase P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P310: Immediately call a POISON CENTER or doctor/physician; P280: Wear eye protection/face protection; P28 Acros Organics
P phrase P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P310: Immediately call a POISON CENTER or doctor/physician; P308 + P313: IF exposed or concerned: Get medi Acros Organics
R phrase R40: Limited evidence of a carcinogenic effect. Acros Organics
R phrase R40: Limited evidence of a carcinogenic effect.; R41: Risk of serious damage to eyes.; R43: May cause sensitisation by skin contact. Acros Organics
R phrase R45: May cause cancer. Acros Organics
R phrase R45: May cause cancer.; R41: Risk of serious damage to eyes.; R43: May cause sensitisation by skin contact.; R51/53: Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.; R68: Possible risks of irreversible effects. 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.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. Acros Organics
S phrase S53: Avoid exposure - obtain special instructions before use. Acros Organics
Hazard T: Toxic Acros Organics
Hazard T: Toxic; N: Dangerous for the environment Acros Organics
Hazard XN: Harmful Acros Organics

Activity (Go SEA)

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