618-89-3

Name Methyl 3-bromobenzoate
CAS 618-89-3
EINECS(EC#) 210-569-9
Molecular Formula C8H7BrO2
MDL Number MFCD00017777
Molecular Weight 215.04
MOL File 618-89-3.mol
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Chemical Properties

Appearance white to light yellow low melting crystalline
Melting point  31-33 °C(lit.)
Boiling point  127-128 °C15 mm Hg(lit.)
density  1.5313 (rough estimate)
refractive index  1.5575
Fp  >230 °F
storage temp.  Sealed in dry,Room Temperature
form  Crystalline Solid or Liquid
color  White to light yellow
Water Solubility  Slightly soluble in water.
BRN  1940810
InChI InChI=1S/C8H7BrO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3
InChIKey KMFJVYMFCAIRAN-UHFFFAOYSA-N
SMILES C(OC)(=O)C1=CC=CC(Br)=C1
CAS DataBase Reference 618-89-3(CAS DataBase Reference)
NIST Chemistry Reference Benzoic acid, 3-bromo-, methyl ester(618-89-3)
EPA Substance Registry System 618-89-3(EPA Substance)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
WGK Germany  3
TSCA  Yes
HS Code  29163990
Storage Class 11 - Combustible Solids

Hazard Information

Material Safety Data Sheet(MSDS)

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