| Identification | Back Directory | [Name]
Siponimod | [CAS]
1378888-43-7 | [Synonyms]
SIPO-013
1-(3-Ethyl-4-(hydroxymethyl)phenyl)ethanone
1-(3-ethyl-4-(hydroxymethyl)phenyl)ethan-1-on
Ethanone, 1-[3-ethyl-4-(hydroxymethyl)phenyl]-
1-(3-ethyl-4-(hydroxymethyl)phenyl)ethan-1-one
1-(3-Ethyl-4-(hydroxymethyl)phenyl)ethanone Ethanone
1-(3-Ethyl-4-hydroxymethylphenyl)ethanone
（Siponimod） | [Molecular Formula]
C11H14O2 | [MDL Number]
MFCD18910891 | [MOL File]
1378888-43-7.mol | [Molecular Weight]
178.23 |
| Chemical Properties | Back Directory | [Boiling point ]
331.9±37.0 °C(Predicted) | [density ]
1.063±0.06 g/cm3(Predicted) | [storage temp. ]
Inert atmosphere,Room Temperature | [pka]
14.26±0.10(Predicted) | [Appearance]
White to off-white Solid | [InChI]
InChI=1S/C11H14O2/c1-3-9-6-10(8(2)13)4-5-11(9)7-12/h4-6,12H,3,7H2,1-2H3 | [InChIKey]
UAOSVSMWAUFYMM-UHFFFAOYSA-N | [SMILES]
C(=O)(C1=CC=C(CO)C(CC)=C1)C |
| Hazard Information | Back Directory | [Uses]
1-3-Ethyl-4-(hydroxymethyl)-phenyl)ethanone is a reagent used in the prepration of Siponimod, it''s salts ans solid forms of the compound. | [Synthesis]
1-Iodo-4-bromo-2-ethylbenzene was synthesized from 2-ethylaniline by a one-pot reaction of aminoprotection, bromination, deprotection and iodination, and then 4-bromo-2-ethylbenzyl alcohol was synthesized from 4-bromo-2-ethylbenzyl alcohol by a one-pot re |
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