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Cas Database |
| Name |
N-(2,2,2-Trifluoroethyl)aniline |
EINECS | N/A |
| CAS No. | 351-61-1 | Density | 1.235g/cm3 |
| PSA | 12.03000 | LogP | 2.73380 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C8H8F3N | Boiling Point | 186°Cat760mmHg |
| Molecular Weight | 175.153 | Flash Point | 66.3°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | A poison by intraperitoneal and intravenous routes. When heated to decomposition it emits toxic vapors of NOx and F−. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
F9995-0049;2,2,2-trifluoroethyl aniline; |
Article Data | 15 |
N-(2,2,2-Trifluoroethyl)aniline Chemical Properties
IUPAC Name: N-(2,2,2-Trifluoroethyl)aniline
Synonyms of N-(2,2,2-Trifluoroethyl)aniline (CAS NO.351-61-1): Aniline, N-(2,2,2-trifluoroethyl)-
InChI: InChI=1/C8H8F3N/c9-8(10,11)6-12-7-4-2-1-3-5-7/h1-5,12H,6H2
InChIKey: IHCPNFMGAKAAKN-UHFFFAOYAO
Std. InChI: InChI=1S/C8H8F3N/c9-8(10,11)6-12-7-4-2-1-3-5-7/h1-5,12H,6H2
Std. InChIKey: IHCPNFMGAKAAKN-UHFFFAOYSA-N
CAS NO: 351-61-1
Molecular Formula: C8H8F3N
Molecular Weight: 175.151
Molecular Structure : .png)
H bond acceptors: 1
H bond donors: 1
Freely Rotating Bonds: 2
Polar Surface Area: 3.24 Å2
Index of Refraction: 1.489
Molar Refractivity: 40.95 cm3
Molar Volume: 141.7 cm3
Surface Tension: 29.1 dyne/cm
Density: 1.235 g/cm3
Flash Point: 66.3 °C
Enthalpy of Vaporization: 42.22 kJ/mol
Boiling Point: 186 °C at 760 mmHg
Vapour Pressure: 0.679 mmHg at 25°C
N-(2,2,2-Trifluoroethyl)aniline Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intravenous | 180mg/kg (180mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00012, | |
| mouse | LDLo | intraperitoneal | 250uL/kg (0.25mL/kg) | "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 2, Pg. 184, 1950. |
N-(2,2,2-Trifluoroethyl)aniline Safety Profile
A poison by intraperitoneal and intravenous routes. When N-(2,2,2-Trifluoroethyl)aniline (CAS NO.351-61-1) is heated to decomposition, it emits toxic vapors of NOx and F−.
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