tert-butyl (3R)-3-methoxy-5-oxopiperidine-1-carboxylate
Basic information
- CAS
2550997-48-1- Standard SMILES
CO[C@@H]1CC(=O)CN(C(=O)OC(C)(C)C)C1- InChIKey
OOZUYXGKPKJPIK-SECBINFHSA-N- Molecular formula
- C11H19NO4
- Average molar mass
- 229.27 g/mol
- Monoisotopic mass
- 229.13140809
Names & identifiers
- Preferred name
- tert-butyl (3R)-3-methoxy-5-oxopiperidine-1-carboxylate
- IUPAC
- tert-butyl (3R)-3-methoxy-5-oxopiperidine-1-carboxylate
Names & synonyms
2550997-48-1Tert-butyl (3R)-3-methoxy-5-oxopiperidine-1-carboxylateRefChem:891823895-034-3tert-butyl(3R)-3-methoxy-5-oxopiperidine-1-carboxylateEN300-22916677
Database identifiers
- CAS
2550997-48-1- PubChem CID
- 154809641
- EC Number
- 895-034-3
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 282
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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