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686766-52-9

686766-52-9 Structure

686766-52-9 Structure
IdentificationBack Directory
[Name]

(2S,4S)-1-(TERT-BUTOXYCARBONYL)-4-(2-FLUORO-PHENOXY)-2-PYRROLIDINECARBOXYLIC ACID
[CAS]

686766-52-9
[Synonyms]

(2S,4S)-1-(TERT-BUTOXYCARBONYL)-4-(2-FLUORO-PHENOXY)-2-PYRROLIDINECARBOXYLIC ACID
1,2-Pyrrolidinedicarboxylic acid, 4-(2-fluorophenoxy)-, 1-(1,1-dimethylethyl) es…
1,2-Pyrrolidinedicarboxylic acid, 4-(2-fluorophenoxy)-, 1-(1,1-dimethylethyl) ester, (2S,4S)-
[Molecular Formula]

C16H20FNO5
[MDL Number]

MFCD08687112
[MOL File]

686766-52-9.mol
[Molecular Weight]

325.33
Chemical PropertiesBack Directory
[Boiling point ]

463.6±45.0 °C(Predicted)
[density ]

1.286±0.06 g/cm3(Predicted)
[form ]

solid
[pka]

3.66±0.40(Predicted)
[InChI]

1S/C16H20FNO5/c1-16(2,3)23-15(21)18-9-10(8-12(18)14(19)20)22-13-7-5-4-6-11(13)17/h4-7,10,12H,8-9H2,1-3H3,(H,19,20)/t10-,12-/m0/s1
[InChIKey]

AUSMQEAACFWSDK-JQWIXIFHSA-N
[SMILES]

FC1=C(O[C@@H]2CN(C(OC(C)(C)C)=O)[C@H](C(O)=O)C2)C=CC=C1
Safety DataBack Directory
[Hazard Codes ]

Xi
[WGK Germany ]

WGK 3
[HazardClass ]

IRRITANT
[Storage Class]

11 - Combustible Solids
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