1-N-Boc-3-(R)-cyanopiperidine
Completing data — refresh the page later to see the latest
Basic information
- CAS
915226-44-7- Standard SMILES
CC(C)(C)OC(=O)N1CCC[C@@H](C#N)C1- InChIKey
UEFZTXGFHKPSFS-VIFPVBQESA-N- Molecular formula
- C11H18N2O2
- Average molar mass
- 210.27 g/mol
- Monoisotopic mass
- 210.13682782
Names & identifiers
- Preferred name
- 1-N-Boc-3-(R)-cyanopiperidine
- IUPAC
- tert-butyl (3R)-3-cyanopiperidine-1-carboxylate
- English name
- (R)-1-N-BOC-3-CYANO-PIPERIDINE
- Molecular formula
- C11H18N2O2
- Molecular weight
- 210.27
Names & synonyms
1-N-Boc-3-(R)-cyanopiperidine915226-44-7DTXSID10427123RefChem:232130DTXCID10377957(R)-1-N-Boc-3-cyano-piperidinetert-butyl (3R)-3-cyanopiperidine-1-carboxylate(r)-1-boc-3-cyanopiperidine(r)-tert-butyl 3-cyanopiperidine-1-carboxylateMFCD05864632tert-butyl (R)-3-cyanopiperidine-1-carboxylate(r)-3-cyano-piperidine-1-carboxylic acid tert-butyl ester
Show more names
(R)-1-N-BOC-3-3-cyano-piperidine(R)-tert-Butyl 3-cyanopiperidine(R)-tert-butyl 3-cyanopiperidine 2-Cyanopiperidine(R)-3-Cyanopiperidine-1-carboxylic acid tert-butyl ester1-Piperidinecarboxylic acid, 3-cyano-, 1,1-dimethylethyl ester, (3R)-
(r)-1-n-boc-3-cyanopiperidineSCHEMBL4221580(R)-1-Boc-3-Cyano-PiperidineUEFZTXGFHKPSFS-VIFPVBQESA-N1-n-boc-3-(r)-cyano-piperidineAKOS007930621DS-13466SY018027
Database identifiers
- CAS
915226-44-7- PubChem CID
- 7019448
- DTXSID
DTXSID10427123- EC Number
- 676-075-4
Properties
Computed structural propertiesFilling in
- XLogP
- 1.3
- Topological polar surface area
- 53.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 285
Physicochemical properties
- Boiling point
- 325.3 · 325.3±35.0 °C(Predicted)
- Density
- 1.07 · 1.07±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- -3.42 · -3.42±0.40(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…