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621-51-2

Name 3-ETHOXYBENZOIC ACID
CAS 621-51-2
EINECS(EC#) 210-690-7
Molecular Formula C9H10O3
MDL Number MFCD00016517
Molecular Weight 166.17
MOL File 621-51-2.mol
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Chemical Properties

Melting point  136-140 °C (lit.)
Boiling point  254.38°C (rough estimate)
density  1.1708 (rough estimate)
refractive index  1.5260 (estimate)
storage temp.  Sealed in dry,2-8°C
form  Solid
pka 4.10±0.10(Predicted)
color  White to off-white
BRN  509159
InChI InChI=1S/C9H10O3/c1-2-12-8-5-3-4-7(6-8)9(10)11/h3-6H,2H2,1H3,(H,10,11)
InChIKey DTFQMPQJMDEWKJ-UHFFFAOYSA-N
SMILES C(O)(=O)C1=CC=CC(OCC)=C1
CAS DataBase Reference 621-51-2(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:Wear suitable protective clothing .
WGK Germany  3
HazardClass  IRRITANT
HS Code  2918999090

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