
CAS Number869570-00-3
SynonymsBoc-L-4-Bromophenylalaninenitrile; Boc-Phe(4-Br)-Nitrile; (2S)-2-(tert-Butoxycarbonylamino)-3-(4-bromophenyl)propanenitrile; (S)-tert-butyl 2-(4-bromophenyl)-1-cyanoethylcarbamate
Molecular FormulaC14H17BrN2O2
Molecular Weight516.58
Purity98.00%
Density1.335
Appearancesolid
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 869570-00-3 |
| Catalog No. | 2A-9058597 |
| Chinese Name | Boc-L-4-溴苯丙氨腈 |
| Synonyms | Boc-L-4-Bromophenylalaninenitrile; Boc-Phe(4-Br)-Nitrile; (2S)-2-(tert-Butoxycarbonylamino)-3-(4-bromophenyl)propanenitrile; (S)-tert-butyl 2-(4-bromophenyl)-1-cyanoethylcarbamate |
| Molecular Formula | C14H17BrN2O2 |
| Molecular Weight | 516.58 |
| Purity | 98.00 |
| Density | 1.335 |
| Appearance | solid |
| PubChem ID | 329778572 |
| MDL Number | MFCD01317015 |
| SMILES | CC(C)(C)OC(=O)NCc1ccc(C[C@H](NC(=O)OCC2c3ccccc3-c4ccccc24)C(O)=O)cc1 |
| InChI | 1S/C30H32N2O6/c1-30(2,3)38-28(35)31-17-20-14-12-19(13-15-20)16-26(27(33)34)32-29(36)37-18-25-23-10-6-4-8-21(23)22-9-5-7-11-24(22)25/h4-15,25-26H,16-18H2,1-3H3,(H,31,35)(H,32,36)(H,33,34)/t26-/m0/s1 |
| InChI Key | QSPDPKLGXGMDAY-SANMLTNESA-N |
| NACRES Code | NA.21 |
| UNSPSC | 12352209 |
| MSDS | msds/58597_1_869570_00_3.pdf |
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