939-54-8

Name 2-Bromoethyl benzoate
CAS 939-54-8
Molecular Formula C9H9BrO2
MDL Number MFCD00059462
Molecular Weight 229.07
MOL File 939-54-8.mol
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Chemical Properties

Boiling point  157-159 °C/20 mmHg (lit.)
density  1.445 g/mL at 25 °C(lit.)
refractive index  n20/D 1.548(lit.)
Fp  >230 °F
storage temp.  Refrigerator, under inert atmosphere
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Oil
color  Colourless to Dark Yellow
Specific Gravity 1.4451.46
InChI InChI=1S/C9H9BrO2/c10-6-7-12-9(11)8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey KNBBDZULQFKSIE-UHFFFAOYSA-N
SMILES C(OC(=O)C1=CC=CC=C1)CBr
CAS DataBase Reference 939-54-8(CAS DataBase Reference)
NIST Chemistry Reference Benzoic acid 2-bromoethyl ester(939-54-8)

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 .
S37/39:Wear suitable gloves and eye/face protection .
WGK Germany  3
HS Code  29163100
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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