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1206124-13-1

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1206124-13-1 Structure

1206124-13-1 Structure
IdentificationBack Directory
[Name]

ethyl 2-(7-hydroxy-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetate(WXG02032)
[CAS]

1206124-13-1
[Synonyms]

Ethyl 2-{7-hydroxy-1H,2H,3H,4H-cyclopenta[b]indol-3-yl}acetate
ethyl 2-(7-hydroxy-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetate
Cyclopent[b]indole-3-acetic acid, 1,2,3,4-tetrahydro-7-hydroxy-, ethyl ester
ethyl 2-(7-hydroxy-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetate(WXG02032)
[Molecular Formula]

C15H17NO3
[MDL Number]

MFCD30803269
[MOL File]

1206124-13-1.mol
[Molecular Weight]

259.3
Chemical PropertiesBack Directory
[Boiling point ]

447.5±40.0 °C(Predicted)
[density ]

1.274±0.06 g/cm3(Predicted)
[storage temp. ]

Store at 0-8 °C
[pka]

10.22±0.40(Predicted)
[Appearance]

white solid
[InChI]

InChI=1S/C15H17NO3/c1-2-19-14(18)7-9-3-5-11-12-8-10(17)4-6-13(12)16-15(9)11/h4,6,8-9,16-17H,2-3,5,7H2,1H3
[InChIKey]

QPXXHQCMPZUYDB-UHFFFAOYSA-N
[SMILES]

N1C2=C(C=C(O)C=C2)C2CCC(CC(OCC)=O)C1=2
Hazard InformationBack Directory
[Uses]

A pharmaceutical intermediate used to prepare etrasimod for the treatment of adult patients with moderate to severe active ulcerative colitis.
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