1261642-35-6

Name Ibuprofen Related Compound C
CAS 1261642-35-6
Molecular Formula C13H17ClO
Molecular Weight 224.73
MOL File 1261642-35-6.mol
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Chemical Properties

Boiling point  316.7±25.0 °C(Predicted)
density  1.043±0.06 g/cm3(Predicted)
InChI InChI=1S/C13H17ClO/c1-9(2)7-11-5-4-6-12(8-11)13(15)10(3)14/h4-6,8-10H,7H2,1-3H3
InChIKey CLXLEWVPLSDPTM-UHFFFAOYSA-N
SMILES C(C1=CC=CC(CC(C)C)=C1)(=O)C(Cl)C

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