| Identification | Back Directory | [Name]
(S)-tert-butyl (2-(2-cyano-4,4-difluoropyrrolidin-1-yl)-2-oxoethyl)carbamate | [CAS]
1448440-50-3 | [Synonyms]
133998
(S)-1-[2-(Boc-amino)acetyl]-4,4-difluoropyrrolidine-2-carbonitrile
(S)-tert-butyl (2-(2-cyano-4,4-difluoropyrrolidin-1-yl)-2-oxoethyl)carbamate
Carbamic acid, N-[2-[(2S)-2-cyano-4,4-difluoro-1-pyrrolidinyl]-2-oxoethyl]-, 1,1-dimethylethyl ester | [Molecular Formula]
C12H17F2N3O3 | [MDL Number]
MFCD29049850 | [MOL File]
1448440-50-3.mol | [Molecular Weight]
289.28 |
| Chemical Properties | Back Directory | [Boiling point ]
465.4±45.0 °C(Predicted) | [density ]
1.26±0.1 g/cm3(Predicted) | [storage temp. ]
Store at room temperature | [pka]
11.55±0.46(Predicted) | [Appearance]
White to off-white Solid | [InChI]
InChI=1S/C12H17F2N3O3/c1-11(2,3)20-10(19)16-6-9(18)17-7-12(13,14)4-8(17)5-15/h8H,4,6-7H2,1-3H3,(H,16,19)/t8-/m0/s1 | [InChIKey]
WOOAQTYGIARQIQ-QMMMGPOBSA-N | [SMILES]
C(OC(C)(C)C)(=O)NCC(N1CC(F)(F)C[C@H]1C#N)=O |
| Hazard Information | Back Directory | [Uses]
(S)-tert-Butyl (2-(2-Cyano-4,4-difluoropyrrolidin-1-yl)-2-oxoethyl)carbamate is an intermediate in the synthesis of (S)-N-(2-(2-Cyano-4,4-difluoropyrrolidin-1-yl)-2-oxoethyl)quinoline-4-carboxamide (UAMC1110) (S687910) which is a useful research chemical and a fibroblast activation protein inhibitor displaying low nanomolar inhibitory potency and high selectivity against related dipeptidyl peptidases. |
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