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111128-12-2

Name 2-(4-Bromomethyl)phenylpropionic acid
CAS 111128-12-2
EINECS(EC#) 627-148-4
Molecular Formula C10H11BrO2
MDL Number MFCD02093445
Molecular Weight 243.1
MOL File 111128-12-2.mol
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Chemical Properties

Appearance beige-cream crystalline powder
Melting point  126-130 °C(lit.)
Boiling point  148°C (rough estimate)
density  1.4557 (rough estimate)
refractive index  1.5220 (estimate)
storage temp.  Keep in dark place,Sealed in dry,Room Temperature
solubility  Chloroform (Slightly), Methanol (Slightly)
form  powder to crystal
pka 4.29±0.10(Predicted)
color  White to Light yellow to Light orange
InChI InChI=1S/C10H11BrO2/c1-7(10(12)13)9-4-2-8(6-11)3-5-9/h2-5,7H,6H2,1H3,(H,12,13)
InChIKey QQXBRVQJMKBAOZ-UHFFFAOYSA-N
SMILES C(O)(=O)C(C1=CC=C(CBr)C=C1)C
CAS DataBase Reference 111128-12-2(CAS DataBase Reference)

Safety Data

Hazard Codes  C,Xi
Risk Statements 
R34:Causes burns.
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 .
S27:Take off immediately all contaminated clothing .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S37/39:Wear suitable gloves and eye/face protection .
RIDADR  UN 1759 8/PG 2
WGK Germany  3
HazardClass  8
PackingGroup  Ⅱ
HS Code  29163990

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