98-16-8
Product Name:
3-Aminobenzotrifluoride
Formula:
C7H6F3N
Synonyms:
α,α,α-Trifluoro-m-toluidine;3-Aminobenzotrifluoride
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | 3-trifluoromethylaniline appears as a colorless liquid with a fishlike odor. Insoluble in water and denser than water. Toxic by ingestion and inhalation. Used to make dyes and pharmaceuticals. |
|---|---|
| Color/Form | COLORLESS TO YELLOW OILY LIQ |
| Odor | Fish-like |
| Boiling Point | 369.5 °F at 764 mmHg (EPA, 1998) |
| Melting Point | 37 °F (EPA, 1998) |
| Flash Point | 185 °F (NTP, 1992) |
| Solubility | Slightly soluble (NTP, 1992) |
| Density | 1.303 at 59.9 °F (EPA, 1998) - Denser than water; will sink |
| Vapor Density | 5.56 (EPA, 1998) - Heavier than air; will sink (Relative to Air) |
| Vapor Pressure | 0.59 [mmHg] |
| Refractive Index | INDEX OF REFRACTION: 1.4787 @ 20 °C/D; MAX ABSORPTION (ALCOHOL): 296 NM (LOG E= 3.45) |
| Kovats Retention Index | 1017.6 |
| Chemical Classes | Nitrogen Compounds -> Amines, Aromatic |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Corrosion Corrosives GHS05  Exclamation Mark Irritant GHS07  Environment GHS09 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H318:Serious eye damage/eye irritation H411:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
| Molecular Weight | 161.12 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Exact Mass | 161.04523368 g/mol |
| Monoisotopic Mass | 161.04523368 g/mol |
| Topological Polar Surface Area | 26 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 132 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
3-trifluoromethylaniline appears as a colorless liquid with a fishlike odor. Insoluble in water and denser than water. Toxic by ingestion and inhalation. Used to make dyes and pharmaceuticals.