| Identification | Back Directory | [Name]
3-(4-Carboxy-isoxazol-3-yl)-piperidine-1-carboxylic acid tert-butyl ester | [CAS]
1334491-82-5 | [Synonyms]
3-(4-Carboxy-isoxazol-3-yl)-piperidine-1-carboxylic acid tert-butyl ester
1-Piperidinecarboxylic acid, 3-(4-carboxy-3-isoxazolyl)-, 1-(1,1-dimethylethyl) ester | [Molecular Formula]
C14H20N2O5 | [MDL Number]
MFCD20232457 | [MOL File]
1334491-82-5.mol | [Molecular Weight]
296.32 |
| Chemical Properties | Back Directory | [Boiling point ]
444.9±45.0 °C(Predicted) | [density ]
1.248±0.06 g/cm3(Predicted) | [form ]
solid | [pka]
3.12±0.36(Predicted) | [InChI]
1S/C14H20N2O5/c1-14(2,3)21-13(19)16-6-4-5-9(7-16)11-10(12(17)18)8-20-15-11/h8-9H,4-7H2,1-3H3,(H,17,18) | [InChIKey]
XRMMKKJZGRQYTF-UHFFFAOYSA-N | [SMILES]
O=C(O)C1=CON=C1C2CN(C(OC(C)(C)C)=O)CCC2 |
| Safety Data | Back Directory | [WGK Germany ]
WGK 3 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Oral
Aquatic Acute 1
Eye Irrit. 2
Skin Irrit. 2
Skin Sens. 1 |
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| Company Name: |
Merck KGaA
|
| Telephone: |
21-20338288 |
| Website: |
www.sigmaaldrich.cn |
|