Basic information
- CAS
215306-00-6- Standard SMILES
CCOC(=O)C[C@H]1[NH2+]CCC[C@H]1NC(=O)OC(C)(C)C- InChIKey
JWIFFLUEVLMGJF-GHMZBOCLSA-O- Molecular formula
- C14H27N2O4+
- Average molar mass
- 287.38 g/mol
- Monoisotopic mass
- 287.19708235
Names & identifiers
- Preferred name
- 3-{[tert-Butoxy(hydroxy)methylidene]amino}-2-(2-ethoxy-2-oxoethyl)piperidin-1-ium
- IUPAC
- ethyl 2-[(2R,3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-ium-2-yl]acetate
- English name
- 3-Boc-amino-2-piperidineacetic acid ethyl ester
- Molecular formula
- C14H26N2O4
- Molecular weight
- 286.37
Names & synonyms
DTXSID60944138(2R,3R)-3-{[tert-Butoxy(hydroxy)methylidene]amino}-2-(2-ethoxy-2-oxoethyl)piperidin-1-ium3-{[tert-Butoxy(hydroxy)methylidene]amino}-2-(2-ethoxy-2-oxoethyl)piperidin-1-iumZinc04203238Zinc04203237Zinc042032363-Boc-amino-2-piperidineacetic acid ethyl esterEthyl 2-(3-((tert-butoxycarbonyl)amino)piperidin-2-yl)acetate2-Piperidineacetic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-, ethyl ester
Database identifiers
- CAS
215306-00-6- PubChem CID
- 40479250
- DTXSID
DTXSID60944138
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 81.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 1
- Complexity
- 339
Chemistry & industry
Suppliers1 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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