| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 11 | Yes |
Popular Name: 4-(trifluoromethyl)aniline 4-(trifluoromethyl)aniline
Find On: PubMed — Wikipedia — Google
CAS Numbers: 455-14-1 , 90774-69-9 , [455-14-1] , [90774-69-9]
"4-Aminobenzotrifluoride, 99%"
4-(Trifluoromethyl)aniline hydrochloride
4-(Trifluoromethyl)aniline hydrochloride, 97%
4-(Trifluoromethyl)aniline hydrochloride, alpha,alpha,alpha-Trifluoro-p-toluidine hydrochloride
4-(Trifluoromethyl)aniline, alpha,alpha,alpha-Trifluoro-p-toluidine
4-(trifluoromethyl)anilinehydrochloride
4-Aminobenzotrifluoride hydrochloride
4-Aminobenzotrifluoride hydrochloride 97%
4-Aminobenzotrifluoride hydrochloride, 97%
4-TRIFLUOROMETHYLANILINE; p-(trifluoromethyl)aniline
alpha,alpha,alpha-Trifluoro-p-toluidine
| 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) | 1.91 | 3.37 | -3.6 | 2 | 1 | 0 | 26 | 161.126 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 117 / 60 | TCI |
| Mp [°C] | 200 | Acros Organics |
| MP | 200 - 202 | Enamine Building Blocks |
| MP | 200...202 | Enamine Building Blocks |
| MP | 200° | Matrix Scientific |
| MP | 3-8° | Fluorochem |
| BP [°C] | 83 (p=12 torr) | Acros Organics |
| BP | 83°/12mm | Fluorochem |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Matrix Scientific |
| Purity | 98% | APIChem |
| Purity | 99% | Fluorochem |
| Melting_Point | ca 240? dec. | Alfa-Aesar |
| Melting_Point | ca 240° dec. | Alfa-Aesar |
| H phrase | H302: Harmful if swallowed | Acros Organics |
| H phrase | H302: Harmful if swallowed; H312: Harmful in contact with skin; H319: Causes serious eye irritation; H335: May cause respiratory irritation; H373: May cause damage to organs through prolonged or repeated exposure; H315: Causes skin irritation; H332: Harmf | Acros Organics |
| H phrase | H312: Harmful in contact with skin | Acros Organics |
| H phrase | H312: Harmful in contact with skin; H332: Harmful if inhaled; H373: May cause damage to organs through prolonged or repeated exposure; H335: May cause respiratory irritation; H315: Causes skin irritation; H319: Causes serious eye irritation; H302: Harmful | Acros Organics |
| Warnings | IRRITANT | 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; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P260: Do not breathe dust/fume/gas/mist/vapors/spray; P301 | Acros Organics |
| _Notes | Precursor to 2-(4-aminophenyl)-substituted tetrahydropyrimidines & imidazolines | Apollo Scientific |
| 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.; R33: Danger of cumulative effects.; 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.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
