845551-44-2

Name 4-BENZYLOXY-3-CHLOROPHENYLBORONIC ACID
CAS 845551-44-2
Molecular Formula C13H12BClO3
MDL Number MFCD04115642
Molecular Weight 262.5
MOL File 845551-44-2.mol

Chemical Properties

Melting point  188-193 °C (lit.)
Boiling point  450.2±55.0 °C(Predicted)
density  1.30±0.1 g/cm3(Predicted)
storage temp.  Inert atmosphere,Room Temperature
form  powder to crystal
pka 7.67±0.17(Predicted)
color  White to Almost white
InChI 1S/C13H12BClO3/c15-12-8-11(14(16)17)6-7-13(12)18-9-10-4-2-1-3-5-10/h1-8,16-17H,9H2
InChIKey AYSMMNDQVZAXQY-UHFFFAOYSA-N
SMILES OB(O)c1ccc(OCc2ccccc2)c(Cl)c1
CAS DataBase Reference 845551-44-2(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 .
WGK Germany  3
HazardClass  IRRITANT
HS Code  29310095
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

Hazard Information

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