| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 11 | No |
Popular Name: 2-Bromo-2'-chloroacetophenone 2-Bromo-2'-chloroacetophenone
Find On: PubMed — Wikipedia — Google
CAS Numbers: 5000-66-8 , [5000-66-8]
2-bromo-1-(2-chlorophenyl)-1-ethanone
2-bromo-1-(2-chlorophenyl)ethan-1-one
2-Bromo-1-(2-chlorophenyl)ethanone
2-Bromo-2'-chloroacetophenone, 95%
2-Bromo-2'-chloroacetophenone, tech.
2-Bromo-2'-chloroacetophenone, Technical grade
2-Chlorophenacyl bromide, tech.
| 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) | 2.83 | 0.58 | -8.93 | 0 | 1 | 0 | 17 | 233.492 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 105?/1mm | Alfa-Aesar |
| BP | 105°/1 mm | Matrix Scientific |
| Boiling_Point | 105°/1mm | Alfa-Aesar |
| BP | 105°/1mmHg | Fluorochem |
| MP | 107 - 108 | Enamine Building Blocks |
| MP | 107...108 | Enamine Building Blocks |
| BP [°C] | 162 - 166 (p=20 torr) | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks |
| Purity | 90% | Fluorochem |
| purity | 95 | Enamine Building Blocks |
| Purity | >95% | Matrix Scientific |
| Hazard | C: Corrosive | Acros Organics |
| H phrase | H318: Causes serious eye damage | Acros Organics |
| H phrase | H318: Causes serious eye damage; H302: Harmful if swallowed; H314: Causes severe skin burns and eye damage | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| melting_point | Oil | KeyOrganics |
| P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting | Acros Organics |
| P phrase | 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 for several minutes. Remove contact lenses, if present and easy to do. Continue r | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R34: Causes burns. | 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.; S45: In case of accident or if you feel unwell, seek medical advice immediat | Acros Organics |
| Warnings | Toxic/Corrosive/Refrigerate/Lachrymator | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.