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20942-70-5

Name 5-tert-butyl-2-iodophenol
CAS 20942-70-5
Molecular Formula C10H13IO
MDL Number MFCD15527200
Molecular Weight 276.11
MOL File 20942-70-5.mol
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Chemical Properties

Melting point  48-49 °C(Solv: pentane (109-66-0))
Boiling point  250.7±28.0 °C(Predicted)
density  1.563±0.06 g/cm3(Predicted)
pka 8?+-.0.10(Predicted)
InChI InChI=1S/C10H13IO/c1-10(2,3)7-4-5-8(11)9(12)6-7/h4-6,12H,1-3H3
InChIKey COYVTCLXNSGLFE-UHFFFAOYSA-N
SMILES C1(O)=CC(C(C)(C)C)=CC=C1I

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