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1286208-05-6

1286208-05-6 Structure

1286208-05-6 Structure
IdentificationBack Directory
[Name]

(S)-tert-Butyl 1-(4-fluorobenzoyl)pyrrolidin-3-ylcarbamate
[CAS]

1286208-05-6
[Synonyms]

(S)-tert-Butyl 1-(4-fluorobenzoyl)pyrrolidin-3-ylcarbamate
Carbamic acid, N-[(3S)-1-(4-fluorobenzoyl)-3-pyrrolidinyl]-, 1,1-dimethylethyl ester
[Molecular Formula]

C16H21FN2O3
[MDL Number]

MFCD17014258
[MOL File]

1286208-05-6.mol
[Molecular Weight]

308.35
Chemical PropertiesBack Directory
[Boiling point ]

457.7±45.0 °C(Predicted)
[density ]

1.20±0.1 g/cm3(Predicted)
[form ]

solid
[pka]

12.08±0.20(Predicted)
[InChI]

1S/C16H21FN2O3/c1-16(2,3)22-15(21)18-13-8-9-19(10-13)14(20)11-4-6-12(17)7-5-11/h4-7,13H,8-10H2,1-3H3,(H,18,21)/t13-/m0/s1
[InChIKey]

FTGOZNIDLXZUMV-ZDUSSCGKSA-N
[SMILES]

FC1=CC=C(C(N2C[C@@H](NC(OC(C)(C)C)=O)CC2)=O)C=C1
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Aquatic Acute 1
Eye Irrit. 2
Skin Irrit. 2
Skin Sens. 1
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