106-40-1

Name 4-Bromoaniline
CAS 106-40-1
EINECS(EC#) 203-393-9
Molecular Formula C6H6BrN
MDL Number MFCD00007822
Molecular Weight 172.02
MOL File 106-40-1.mol

Chemical Properties

Appearance brown crystals
Melting point  56-62 °C (lit.)
Boiling point  230-250 °C
bulk density 810kg/m3
density  1.497
refractive index  1.5680 (estimate)
Fp  222-224°C
storage temp.  Store below +30°C.
solubility  ethanol: soluble0.5g/10 mL, clear, colorless to almost colorless
form  crystalline
pka 3.86(at 25℃)
color  white to light yellow
Odor Sweetish
Stability: Stable. Combustible. Incompatible with strong oxidizing agents, peroxides, acids, acid chlorides, acid anhydrides, chloroformates. May be air sensitive.
Water Solubility  <0.1 g/100 mL at 23 ºC
Detection Methods GC,NMR
Merck  14,1404
BRN  742031
Dielectric constant 13.0(-7℃)
InChI 1S/C6H6BrN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2
InChIKey WDFQBORIUYODSI-UHFFFAOYSA-N
SMILES Nc1ccc(Br)cc1
CAS DataBase Reference 106-40-1(CAS DataBase Reference)
NIST Chemistry Reference 4-Bromoaniline(106-40-1)
Storage Precautions Light sensitive
EPA Substance Registry System 106-40-1(EPA Substance)

Safety Data

Symbol(GHS)  Skull and Crossbones (GHS06)Health Hazard (GHS08)Environment (GHS09)
GHS06,GHS08,GHS09
Signal word  Danger
Hazard statements  H302-H311+H331-H373-H410
Precautionary statements  P273-P280-P301+P312-P302+P352+P312-P304+P340+P311-P314
Hazard Codes  Xn
Risk Statements 
R21/22:Harmful in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37:Wear suitable protective clothing and gloves .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
RIDADR  UN 2811 6.1/PG 3
WGK Germany  3
RTECS  BW9280000
F  8-9-23
Hazard Note  Harmful
TSCA  Yes
HazardClass  6.1
PackingGroup  III
HS Code  29214210
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Dermal
Acute Tox. 3 Inhalation
Acute Tox. 4 Oral
Aquatic Acute 1
Aquatic Chronic 1
STOT RE 2
Hazardous Substances Data 106-40-1(Hazardous Substances Data)
Toxicity
LD50 orally in Rabbit: 456 mg/kg LD50 dermal Rat 536 mg/kg

Hazard Information

Material Safety Data Sheet(MSDS)

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