58530-13-5

Name 3-bromo-5-methylbenzoic acid
CAS 58530-13-5
Molecular Formula C8H7BrO2
MDL Number MFCD02684926
Molecular Weight 215.04
MOL File 58530-13-5.mol

Chemical Properties

Melting point  178-179.5℃
Boiling point  320.3±30.0 °C(Predicted)
density  1.599±0.06 g/cm3 (20 ºC 760 Torr)
storage temp.  Sealed in dry,Room Temperature
form  solid
pka 3.88±0.10(Predicted)
color  Pale yellow
InChI InChI=1S/C8H7BrO2/c1-5-2-6(8(10)11)4-7(9)3-5/h2-4H,1H3,(H,10,11)
InChIKey NWOMVQDBDBUANF-UHFFFAOYSA-N
SMILES C(O)(=O)C1=CC(C)=CC(Br)=C1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338
HS Code  2916310090

Hazard Information

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