774-81-2

Name 3-BROMO-4-METHOXYPHENYLACETIC ACID
CAS 774-81-2
Molecular Formula C9H9BrO3
MDL Number MFCD00017538
Molecular Weight 245.07
MOL File 774-81-2.mol

Chemical Properties

Melting point  115-117°C
Boiling point  361.1±27.0 °C(Predicted)
density  1.560±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
solubility  soluble in Methanol
form  powder to crystal
pka 4.27±0.10(Predicted)
color  White to Light yellow
InChI InChI=1S/C9H9BrO3/c1-13-8-3-2-6(4-7(8)10)5-9(11)12/h2-4H,5H2,1H3,(H,11,12)
InChIKey POTVGQUUEQTPNA-UHFFFAOYSA-N
SMILES C1(CC(O)=O)=CC=C(OC)C(Br)=C1
CAS DataBase Reference 774-81-2(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Risk Statements 
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 .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
RIDADR  UN 3077 9/PG III
Hazard Note  Irritant
HazardClass  IRRITANT
PackingGroup  III
HS Code  2918999090

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