In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2004 | 15 | No |
Popular Name: 4-Fluoro-3-(trifluoromethyl)phenacyl bromide 4-Fluoro-3-(trifluoromethyl)phen…
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CAS Numbers: 537050-14- , 537050-14-9 , [537050-14-9]
2-Bromo-1-(4-fluoro-3-(trifluoromethyl)phenyl)ethanone
2-Bromo-4'-fluoro-3'-(trifluoromethyl)acetophenone
4-Fluoro-3-(trifluoromethyl)phenacyl bromide 95%
4-Fluoro-3-(Trifluoromethyl)Phenacyl Bromide; (2-Bromo-4'-fluoro-3'-(trifluoromethyl)acetophenone)
4-Fluoro-3-(trifluoromethyl)phenacylbromid
4-Fluoro-3-(trifluoromethyl)phenacylbromide
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) | 3.18 | 6.77 | -10.72 | 0 | 1 | 0 | 17 | 285.034 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Mp [°C] | 42 - 44 | Acros Organics |
MP | 42-44° | Matrix Scientific |
Purity | 95% | Matrix Scientific |
Purity | 98% | Fluorochem |
Hazard | C: Corrosive | Acros Organics |
Warnings | Corrosive/Irritant-Harmful/Refrigerate/Lachrymator | Matrix Scientific |
H phrase | H332: Harmful if inhaled | Acros Organics |
H phrase | H332: Harmful if inhaled; H302: Harmful if swallowed; H318: Causes serious eye damage; H312: Harmful in contact with skin; H314: Causes severe skin burns and eye damage | Acros Organics |
Warnings | IRRITANT-HARMFUL, KEEP COLD, LACHRYMATOR, CORROSIVE | Matrix Scientific |
P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection | Acros Organics |
P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water | Acros Organics |
R phrase | R20/21/22: Harmful by inhalation, in contact with skin and if swallowed. | Acros Organics |
R phrase | R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.; R34: Causes burns. | Acros Organics |
S phrase | S22: Do not breathe dust. | Acros Organics |
S phrase | S22: Do not breathe dust.; 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.; S45: In case of accident or if you feel unwell, s | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.