HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-Amino-1-N-Cbz-piperidine
Benzyl 4-aminopiperidine-1-carboxylate · N-CBZ-4-aMinepiperidin · 4-Amino-1-Z-piperidine · N-CBZ-4-aminepiperidine · 1-CBZ-4-AMINOPIPERIDINE · 4-AMINO-1-N-CBZ-PIPERIDINE · 1-N-CBZ-4-AMINO-PIPERIDINE · 4-Amino-1-carbobenzoxypiperidine
Identifiers & Physical Properties
| CAS No. | 120278-07-1 |
|---|---|
| Molecular formula | C13H18N2O2 |
| Average molar mass | 234.29 g/mol |
| Monoisotopic mass | 234.13682782 g/mol |
| SMILES | NC1CCN(C(=O)OCc2ccccc2)CC1 |
| InChIKey | YYIQGSYCCNQAGV-UHFFFAOYSA-N |
| PubChem CID | 17846640 |
| EC No. | 675-875-0 |
| DTXSID | DTXSID50591251 |
Chemical & Physical Properties
| XLogP | 1.2 |
|---|---|
| Topological polar surface area | 55.6 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 3 |
| Heavy atoms | 17 |
| Formal charge | 0 |
| Complexity | 244 |
| Melting point | 68 °C(dec.) |
| Boiling point | 367.2±42.0 °C(Predicted) |
| Density | 1.151±0.06 g/cm3(Predicted) |
| Storage conditions | Keep in dark place,Inert atmosphere,Room temperature |
| Physical state | powder to lump |
| pKa (acidity coefficient) | 10.07±0.20(Predicted) |
| Color | White to Light yellow |
| Solubility | Slightly soluble in water. |
| InChI | InChI=1S/C13H18N2O2/c14-12-6-8-15(9-7-12)13(16)17-10-11-4-2-1-3-5-11/h1-5,12H,6-10,14H2 |
| InChIKey | YYIQGSYCCNQAGV-UHFFFAOYSA-N |
| SMILES | N1(C(OCC2=CC=CC=C2)=O)CCC(N)CC1 |
| GHS pictogram | GHS07 |
| Signal word | Warning |
| GHS hazard statements | H315-H319-H335 |
| GHS precautionary statements | P261-P280a-P304+P340-P305+P351+P338-P405-P501a |
| Hazard symbols | Xn |
| Risk statements (R) | 22-36/37/38 |
| Safety statements (S) | 26-37-60 |
| UN transport number | UN3259 |
| Hazard class | 8 |
| Customs code | 29333990 |
| Limited quantities | 5.0 kg (11 lbs) (solid) |
| Excepted quantities | Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L) |
Safety & Regulations
| GHS classification | WarningH315 (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)Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| UN transport number | UN3259 |
| Customs code | 29333990 |
| Risk statements (R) | 22-36/37/38 |
| Signal word | Warning |
| GHS pictogram | GHS07 |
| Hazard symbols | Xn |
| Safety statements (S) | 26-37-60 |
| Hazard class | 8 |
| GHS hazard statements | H315-H319-H335 |
| Limited quantities | 5.0 kg (11 lbs) (solid) |
| Excepted quantities | Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L) |
| GHS precautionary statements | P261-P280a-P304+P340-P305+P351+P338-P405-P501a |
Applications & Uses
Uses
It is an important raw material and intermediate used in organic synthesis agrochemical, pharmaceutical and dyestuff field.