tert-Butyl 4-hydroxy-4-[(methylamino)methyl]piperidine-1-carboxylate
Basic information
- CAS
1073559-55-3- Standard SMILES
CNCC1(O)CCN(C(=O)OC(C)(C)C)CC1- InChIKey
QBUNPDBAKSQTFE-UHFFFAOYSA-N- Molecular formula
- C12H24N2O3
- Average molar mass
- 244.33 g/mol
- Monoisotopic mass
- 244.17869263
Names & identifiers
- Preferred name
- tert-Butyl 4-hydroxy-4-[(methylamino)methyl]piperidine-1-carboxylate
- IUPAC
- tert-butyl 4-hydroxy-4-(methylaminomethyl)piperidine-1-carboxylate
- English name
- tert-Butyl 4-hydroxy-4-[(methylamino)-methyl]piperidine-1-carboxylate
- Molecular formula
- C12H24N2O3
- Molecular weight
- 244.33
Names & synonyms
1073559-55-3tert-Butyl 4-hydroxy-4-[(methylamino)methyl]piperidine-1-carboxylatetert-Butyl 4-hydroxy-4-((methylamino)methyl)piperidine-1-carboxylate1-Boc-4-hydroxy-4-methylaminomethyl-piperidineMFCD11920519tert-butyl 4-hydroxy-4-(methylaminomethyl)piperidine-1-carboxylatetert-Butyl 4-hydroxy-4-[(methylamino)-methyl]piperidine-1-carboxylateSCHEMBL3031720QBUNPDBAKSQTFE-UHFFFAOYSA-NYSB55955AKOS022265616AS-8857
Show more names
1-Piperidinecarboxylic acid, 4-hydroxy-4-[(methylamino)methyl]-, 1,1-dimethylethyl ester
AT50705SB30483DB-419779CS-0138215EN300-1213755F6545-6626tert-Butyl4-hydroxy-4-((methylamino)methyl)piperidine-1-carboxylate1,1-Dimethylethyl 4-hydroxy-4-[(methylamino)methyl]-1-piperidine-carboxylate
Database identifiers
- CAS
1073559-55-3- PubChem CID
- 39348378
- EC Number
- 118-108-2
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 265
Physicochemical properties
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2933399990
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…