50921-39-6

Name 1-(4-CHLOROPHENYL)-1-CYCLOBUTANECARBOXYLIC ACID
CAS 50921-39-6
EINECS(EC#) 256-847-3
Molecular Formula C11H11ClO2
MDL Number MFCD00001324
Molecular Weight 210.66
MOL File 50921-39-6.mol
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Chemical Properties

Appearance light yellow to purple crystalline powder
Melting point  80-90 °C
Boiling point  302.49°C (rough estimate)
density  1.1742 (rough estimate)
refractive index  1.5500 (estimate)
form  Crystalline Powder
pka 4.26±0.20(Predicted)
color  Light yellow to purple
InChI InChI=1S/C11H11ClO2/c12-9-4-2-8(3-5-9)11(10(13)14)6-1-7-11/h2-5H,1,6-7H2,(H,13,14)
InChIKey XYSRHOKREWGGFE-UHFFFAOYSA-N
SMILES C1(C2=CC=C(Cl)C=C2)(C(O)=O)CCC1
CAS DataBase Reference 50921-39-6

Safety Data

Hazard Codes  Xi
Risk Statements 
Safety Statements 
HS Code  29163990

Hazard Information

Spectrum Detail

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