![N-[(S)-(+)-1-(Ethoxycarbonyl)-3-phenylpropyl]-L-alanine Structure](https://www.chemicalbook.com/CAS/GIF/82717-96-2.gif)
N-[(S)-(+)-1-(Ethoxycarbonyl)-3-phenylpropyl]-L-alanine
- Product NameN-[(S)-(+)-1-(Ethoxycarbonyl)-3-phenylpropyl]-L-alanine
- CAS82717-96-2
- CBNumberCB8700827
- MFC15H21NO4
- MW279.34
- EINECS406-310-6
- MDL NumberMFCD00209976
- MOL File82717-96-2.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 150-152 °C(lit.) |
| Boiling point | 422.1°C (rough estimate) |
| alpha | +28° (20℃/D)(c=1, CH3OH) |
| Density | 1.1083 (rough estimate) |
| vapor pressure | 1.95hPa at 25℃ |
| refractive index | 29.5 ° (C=1, MeOH) |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| solubility | 6g/l |
| pka | 2.14±0.10(Predicted) |
| form | Crystalline Powder |
| color | White |
| optical activity | [α]20/D +28°, c = 1 in methanol |
| Water Solubility | 100mg/L at 25℃ |
| BRN | 3619501 |
| Major Application | peptide synthesis |
| InChI | 1S/C15H21NO4/c1-3-20-15(19)13(16-11(2)14(17)18)10-9-12-7-5-4-6-8-12/h4-8,11,13,16H,3,9-10H2,1-2H3,(H,17,18)/t11-,13-/m0/s1 |
| InChIKey | CEIWXEQZZZHLDM-AAEUAGOBSA-N |
| SMILES | CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(O)=O |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319-H335 | |||||||||
| Precautionary statements | P261-P280a-P304+P340-P305+P351+P338-P405-P501a | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 36/37/38 | |||||||||
| Safety Statements | 37/39-26-36 | |||||||||
| WGK Germany | 3 | |||||||||
| HS Code | 29224999 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| NFPA 704: |
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