184368-70-5 (trans-2,6-Dimethyl-4-oxo-piperidine-1-carboxylic acid tert-butyl ester,tert-butyl trans-2,6-dimethyl-4-oxo-piperidine-1-carboxylate)

CAS号:
184368-70-5
中文名称:
trans-2,6-Dimethyl-4-oxo-piperidine-1-carboxylic acid tert-butyl ester
英文名称:
tert-butyl trans-2,6-dimethyl-4-oxo-piperidine-1-carboxylate
分子式:
C12H21NO3
分子量:
227.300043821335

trans-2,6-Dimethyl-4-oxo-piperidine-1-carboxylic acid tert-butyl ester(184368-70-5)名称与标识符

名称

中文别名:
trans-2,6-Dimethyl-4-oxo-piperidine-1-carboxylic acid tert-butyl ester;
英文别名:
trans-2,6-Dimethyl-4-oxo-piperidine-1-carboxylic acid tert-butyl ester;trans-2,6-Dimethylpiperidin-4-one,N-BOCprotected;tert-butyl trans-2,6-dimethyl-4-oxo-piperidine-1-carboxylate;N-Boc-trans-2,6-Dimethyl-4-oxopiperidine;(2R,6R)-2,6-Dimethyl-4-oxo-piperidine-1-carboxylic acid t-butyl ester;MFCD22377542;(2R,6R)-2,6-Dimethyl-4-oxo-piperidine-1-carboxylicacidtert-butylester;(2R,6R)-1-Boc-2,6-dimethyl-4-oxo-piperidine;(2R,6R)-rel-tert-Butyl 2,6-dimethyl-4-oxopiperidine-1-carboxylate;N-t-BOC-trans-2,6-Dimethyl-4-Oxopiperidine;rel-tert-Butyl (2R,6R)-2,6-dimethyl-4-oxopiperidine-1-carboxylate;CS-0140256;TRANS-TERT-BUTYL 2,6-DIMETHYL-4-OXOPIPERIDINE-1-CARBOXYLATE;N-t-BOC-trans-2,6-Dimethyl-4-Oxopiperidine, AldrichCPR;(2R,6R)-rel-2,6-Dimethyl-4-oxo-1,1-dimethylethyl Ester 1-Piperidine Carboxylic Acid;MFCD19230166;184368-70-5;tert-butyl (2R,6R)-2,6-dimethyl-4-oxopiperidine-1-carboxylate;1-Piperidinecarboxylic acid, 2,6-dimethyl-4-oxo-, 1,1-dimethylethylester, trans-;1821774-86-0;SCHEMBL16338682;AS-0804;(2R,6R)-tert-Butyl 2,6-dimethyl-4-oxopiperidine-1-carboxylate;AS-83494;

标识符

MDL:
MFCD19230166
InChIKey:
ADBYGASBXODWTQ-RKDXNWHRSA-N
Inchi:
1S/C12H21NO3/c1-8-6-10(14)7-9(2)13(8)11(15)16-12(3,4)5/h8-9H,6-7H2,1-5H3/t8-,9-/m1/s1
SMILES:
O(C(C)(C)C)C(N1[C@H](C)CC(C[C@H]1C)=O)=O

trans-2,6-Dimethyl-4-oxo-piperidine-1-carboxylic acid tert-butyl ester(184368-70-5)物化性质

实验特性

  • 沸点 : 308.2±35.0℃ at 760 mmHg

计算特性

  • 精确分子量 : 227.15214353g/mol
  • 氢键供体数量 : 0
  • 氢键受体数量 : 4
  • 可旋转化学键数量 : 3
  • 同位素质量 : 227.15214353g/mol
  • 重原子数量 : 16
  • 复杂度 : 279
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 2
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 1.4
  • 拓扑分子极性表面积 : 46.6Ų

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