Basic information
- CAS
1000576-83-9- Standard SMILES
CN(C)C1CCCN(C(=O)OC(C)(C)C)C1- InChIKey
HFIAGQNFPTWBQZ-UHFFFAOYSA-N- Molecular formula
- C12H24N2O2
- Average molar mass
- 228.33 g/mol
- Monoisotopic mass
- 228.18377801
Names & identifiers
- Preferred name
- Tert-butyl 3-(dimethylamino)piperidine-1-carboxylate
- IUPAC
- tert-butyl 3-(dimethylamino)piperidine-1-carboxylate
- English name
- R-3-Dimethylamino-N-Boc-piperidine
- Molecular formula
- C12H24N2O2
- Molecular weight
- 228.33
Names & synonyms
1000576-83-9tert-butyl 3-(dimethylamino)piperidine-1-carboxylateN-Boc-3-dimethylaminopiperidineS-N-Boc-3-dimethylaminopiperidineMFCD098785921-N-Boc-3-(Dimethylamino)piperidineR-N-Boc-3-dimethylaminopiperidine1-Piperidinecarboxylic acid, 3-(diMethylaMino)-, 1,1-diMethylethyl ester1-(tert-butyloxycarbonyl)-3-dimethylaminopiperidineSCHEMBL8033953-Dimethylamino-N-Boc-piperidineDTXSID10659962
Show more names
S-3-Dimethylamino-N-Boc-piperidine(S)-1-N-BOC-3-(DIMETHYLAMINO)PIPERIDINE(R)-1-N-BOC-3-(DIMETHYLAMINO)PIPERIDINE3-(dimethylamino)-1-piperidinecarboxylic acid tert-butyl ester1-Piperidinecarboxylic acid, 3-(diMethylaMino)-, 1,1-diMethylethyl ester（WS203513）
HFIAGQNFPTWBQZ-UHFFFAOYSA-NR-3-Dimethylamino-N-Boc-piperidineAKOS013214715AS-72933DB-371423CS-0002005W17545F600159
Database identifiers
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 246
Physicochemical properties
- Boiling point
- 295.431 · 295.431±33.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.012 · 1.012±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 8.443 · 8.443±0.20(predicted)
Chemistry & industry
Suppliers1 total
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Related reactions
1 records
Compound notes
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