106-40-1
Product Name:
4-Bromoaniline
Formula:
C6H6BrN
Synonyms:
4-Bromoaniline;p-Bromoaniline, p-Bromophenylamine
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | P-bromoaniline is a brown solid with a sweet odor. (NTP, 1992) |
|---|---|
| Color/Form | Bipyramidal rhombic crystals, needles from 60% alcohol |
| Boiling Point | Decomposes (NTP, 1992) |
| Melting Point | 151.5 °F (NTP, 1992) |
| Solubility | less than 1 mg/mL at 73 °F (NTP, 1992) |
| Density | 1.497 at 212 °F (NTP, 1992) - Denser than water; will sink |
| Vapor Density | 5.9 (Air = 1) |
| Vapor Pressure | 0.04 [mmHg] |
| LogP | log Kow = 2.26 |
| Dissociation Constants | pKa = 3.86 at 25 °C (conjugate acid) |
| Kovats Retention Index | 1248 1248 1245 |
| Other Experimental Properties | Aqueous solutions of 4-bromoaniline are slightly alkaline |
| Chemical Classes | Nitrogen Compounds -> Amines, Aromatic |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Skull and Crossbones Acute Toxicity GHS06  Health Hazard GHS08  Environment GHS09 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H373:Specific target organ toxicity, repeated exposure H410:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P314:Get medical advice/attention if you feel unwell. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. |
COMPUTED DESCRIPTORS
| Molecular Weight | 172.02 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 170.96836 g/mol |
| Monoisotopic Mass | 170.96836 g/mol |
| Topological Polar Surface Area | 26 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 66.9 |
| 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
P-bromoaniline is a brown solid with a sweet odor. (NTP, 1992)