(R)-tert-Butyl 3-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate
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Basic information
- CAS
865157-02-4- Standard SMILES
COC(=O)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1- InChIKey
BTYQWISIPUWRJR-SNVBAGLBSA-N- Molecular formula
- C13H23NO4
- Average molar mass
- 257.33 g/mol
- Monoisotopic mass
- 257.16270821
Names & identifiers
- Preferred name
- (R)-tert-Butyl 3-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate
- IUPAC
- tert-butyl (3R)-3-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate
- English name
- (R)-1-Boc-3-piperidineacetic acid methyl ester
- Molecular formula
- C13H23NO4
- Molecular weight
- 257.33
Names & synonyms
865157-02-4(R)-tert-Butyl 3-(2-methoxy-2-oxoethyl)piperidine-1-carboxylatetert-Butyl (3R)-3-(2-methoxy-2-oxoethyl)piperidine-1-carboxylatetert-butyl (R)-3-(2-methoxy-2-oxoethyl)piperidine-1-carboxylatetert-butyl (3R)-3-(2-methoxy-2-oxo-ethyl)piperidine-1-carboxylate(R)-1-Boc-3-Piperidineacetic Acid Methyl EsterSCHEMBL1048155DTXSID20654367BTYQWISIPUWRJR-SNVBAGLBSA-N(R)-tert-Butyl3-(2-methoxy-2-oxoethyl)piperidine-1-carboxylateDB-020715DB-076672
Show more names
Methyl (R)-1-Boc-3-piperidineacetate(R)-1-Boc-3-Piperidine acetate methyl ester(R)-1-Boc-3-(2-methoxy-2-oxoethyl)piperidine(R)-N-Boc-3-Piperidine acetic acid methyl ester3-Piperidineacetic acid, 1-[(1,1-diMethylethoxy)carbonyl]-, Methyl ester, (3R)-
(3R)-1-[(1,1-dimethylethoxy)carbonyl]-3-Piperidineacetic acid methyl ester(R)-3-Methoxycarbonylmethyl-piperidine-1-carboxylic acid tert-butyl ester
Database identifiers
- CAS
865157-02-4- PubChem CID
- 40429391
- DTXSID
DTXSID20654367
Properties
Computed structural propertiesFilling in
- XLogP
- 1.7
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 309
Physicochemical properties
- Boiling point
- 323.1 · 323.1±15.0 °C(Predicted)
- Density
- 1.062 · 1.062±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- -1.99 · -1.99±0.40(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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