L-Histidine, N,1-bis[(1,1-dimethylethoxy)carbonyl]-, methyl ester | 20898-43-5
L-Histidine, N,1-bis[(1,1-dimethylethoxy)carbonyl]-, methyl ester
20898-43-5
C17H27N3O6
369.41278
名称和标识符
InChIKey |
ZYCZFTGHOVFXLZ-LBPRGKRZSA-N |
Inchi |
InChI=1S/C17H27N3O6/c1-16(2,3)25-14(22)19-12(13(21)24-7)8-11-9-20(10-18-11)15(23)26-17(4,5)6/h9-10,12H,8H2,1-7H3,(H,19,22)/t12-/m0/s1 |
SMILES |
CC(C)(OC(N[C@H](C(OC)=O)CC1=CN(C(OC(C)(C)C)=O)C=N1)=O)C |
别名信息
- 英文别名 -
- L-Histidine, N,1-bis[(1,1-dimethylethoxy)carbonyl]-, methyl ester
- methyl (S)-3-[1-(1,1-dimethylethoxycarbonyl)-1H-imidazol-4-yl]-2-[(1,1-dimethylethoxycarbonyl)amino]propionate
- 4-(2-tert-butoxycarbonylamino-2(S)-methoxycarbonyl-ethyl)-imidazole-1-carboxylic acid tert-butyl ester
- N(α),N(τ)-bis-(t-butoxycarbonyl)-L-histidine methyl ester
- N(α),N(τ)-bis[(1,1-dimethylethoxy)carbonyl]-L-histidine methyl ester
- N(α),N(τ)-bis-t-butoxycarbonyl-L-histidine methyl ester
- N-1-Bis[t-butoxycarbonyl]-L-histidine methyl ester
- N-α-(tert-butoxycarbonyl)-1-(tert-butoxycarbonyl)-L-histidine methyl ester
物化性质
实验特性
LogP |
2.66600 |
PSA |
108.75000 |
熔点 |
113-116 °C(lit.) |
计算特性
精确分子量 |
369.19000 |
氢键供体数量 |
1 |
氢键受体数量 |
9 |
可旋转化学键数量 |
11 |
重原子数量 |
26 |
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