| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2004 | 13 | No |
Popular Name: 2-(Trifluoromethyl)benzoyl chloride 2-(Trifluoromethyl)benzoyl chloride
Find On: PubMed — Wikipedia — Google
CAS Numbers: 312-94-7 , 329-15-7 , [312-94-7]
(2-Chlorocarbonyl)benzotrifluoride, alpha,alpha,alpha-Trifluoro-o-toluoyl chloride
2-(Trifluoromethyl)benzoyl chloride 98%
2-(Trifluoromethyl)benzoyl chloride, 98%
2-(Trifluoromethyl)BenzoylChloride
2-Trifluoromethylbenzoyl chloride
4-(Trifluoromethyl)BenzoylChloride
?,?,?-Trifluoro-o-toluoyl chloride
alpha,alpha,alpha-Trifluoro-o-toluoyl chloride
o-Trifluoromethylbenzoyl chloride
| 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) | 3.24 | 3.24 | -7.97 | 0 | 1 | 0 | 17 | 208.566 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 22 | Acros Organics |
| Melting_Point | 22? | Alfa-Aesar |
| Melting_Point | 22° | Alfa-Aesar |
| BP [°C] | 84 - 85 (p=16 torr) | Acros Organics |
| Boiling_Point | 89-90?/16mm | Alfa-Aesar |
| Boiling_Point | 89-90°/16mm | Alfa-Aesar |
| BP | 90 / 15 | TCI |
| BP | 90°/16mm | Matrix Scientific |
| Purity | 98% | Fluorochem |
| Purity | 99% | Matrix Scientific |
| Hazard | C: Corrosive | Acros Organics |
| Warnings | Corrosive/Lachrymator | Matrix Scientific |
| H phrase | H314: Causes severe skin burns and eye damage | Acros Organics |
| H phrase | H314: Causes severe skin burns and eye damage; H318: Causes serious eye damage; EUH029: Contact with water liberates toxic gas | Acros Organics |
| Warnings | LACHRYMATOR, CORROSIVE | Matrix Scientific |
| 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 | R29: Contact with water liberates toxic gas. | Acros Organics |
| R phrase | R29: Contact with water liberates toxic gas.; R34: Causes burns. | Acros Organics |
| S phrase | S8: Keep container dry. | Acros Organics |
| S phrase | S8: Keep container dry.; 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, see | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.