591-17-3

Name 3-Bromotoluene
CAS 591-17-3
EINECS(EC#) 209-702-3
Molecular Formula C7H7Br
MDL Number MFCD00000085
Molecular Weight 171.03
MOL File 591-17-3.mol

Chemical Properties

Appearance colorless to light yellow liqui
Melting point  -40 °C
Boiling point  183.7 °C(lit.)
density  1.41 g/mL at 25 °C(lit.)
vapor pressure  2.04 hPa ( 25 °C)
refractive index  n20/D 1.552(lit.)
Fp  140 °F
storage temp.  Store below +30°C.
solubility  0.05g/l
form  Liquid
color  Clear colorless to light yellow
Specific Gravity 1.410
Water Solubility  insoluble
Merck  14,1439
BRN  1903633
Dielectric constant 5.3600000000000003
InChI 1S/C7H7Br/c1-6-3-2-4-7(8)5-6/h2-5H,1H3
InChIKey WJIFKOVZNJTSGO-UHFFFAOYSA-N
SMILES Cc1cccc(Br)c1
CAS DataBase Reference 591-17-3(CAS DataBase Reference)
NIST Chemistry Reference Benzene, 1-bromo-3-methyl-(591-17-3)
EPA Substance Registry System 591-17-3(EPA Substance)

Safety Data

Symbol(GHS)  Flame (GHS02)Skull and Crossbones (GHS06)Environment (GHS09)
GHS02,GHS06,GHS09
Signal word  Danger
Hazard statements  H226-H302-H331-H411
Precautionary statements  P210-P233-P240-P273-P301+P312-P304+P340+P311
Hazard Codes  Xn,Xi
Risk Statements 
R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
RIDADR  UN 1993 3/PG 3
WGK Germany  3
RTECS  XS7965400
F  8
Hazard Note  Harmful/Irritant
TSCA  Yes
HazardClass  3
HS Code  29036990
Storage Class 3 - Flammable liquids
Hazard Classifications Acute Tox. 3 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
STOT SE 3
Hazardous Substances Data 591-17-3(Hazardous Substances Data)

Hazard Information

Material Safety Data Sheet(MSDS)

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