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2019-34-3

Name 3-(4-Chlorophenyl)propanoic acid
CAS 2019-34-3
Molecular Formula C9H9ClO2
MDL Number MFCD00016555
Molecular Weight 184.62
MOL File 2019-34-3.mol
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Chemical Properties

Melting point  127-131 °C (lit.)
Boiling point  263.86°C (rough estimate)
density  1.1989 (rough estimate)
refractive index  1.5242 (estimate)
storage temp.  Sealed in dry,Room Temperature
form  solid
pka 4.61(at 25℃)
color  White to off white
InChI InChI=1S/C9H9ClO2/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5H,3,6H2,(H,11,12)
InChIKey BBSLOKZINKEUCR-UHFFFAOYSA-N
SMILES C1(CCC(O)=O)=CC=C(Cl)C=C1
CAS DataBase Reference 2019-34-3(CAS DataBase Reference)
NIST Chemistry Reference 3-(4-Chlorophenyl)propionic acid(2019-34-3)

Safety Data

Hazard Codes  Xn,Xi
Risk Statements 
R22:Harmful if swallowed.
R41:Risk of serious damage to eyes.
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  2
HazardClass  IRRITANT
HS Code  29163990
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Eye Dam. 1

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