157604-46-1 ((S)-N-Boc-2,2-二甲基噁唑烷-4-羧酸甲酯,3-tert-butyl 4-methyl 2,2-dimethyl-1,3-oxazolidine-3,4-dicarboxylate)

CAS号:
157604-46-1
中文名称:
(S)-N-Boc-2,2-二甲基噁唑烷-4-羧酸甲酯
英文名称:
3-tert-butyl 4-methyl 2,2-dimethyl-1,3-oxazolidine-3,4-dicarboxylate
分子式:
C12H21NO5
分子量:
259.298844099045

(S)-N-Boc-2,2-二甲基噁唑烷-4-羧酸甲酯(157604-46-1)名称与标识符

名称

中文别名:
(S)-N-Boc-2,2-二甲基噁唑烷-4-羧酸甲酯;N-BOC-2,2-二甲基噁唑烷-4-羧酸甲酯;
英文别名:
3-tert-Butyl 4-methyl 2,2-dimethyloxazolidine-3,4-dicarboxylate;3,4-Oxazolidinedicarboxylicacid, 2,2-dimethyl-, 3-(1,1-dimethylethyl) 4-methyl ester;Methyl 3-(tert-butoxycarbonyl)-2,2-dimethyl-4-oxazolidinecarboxylate;(S)-N-Boc-2,2-dimethyloxazolindine-4-carboxylic acid methyl ester;3-tert-butyl 4-methyl 2,2-dimethyl-1,3-oxazolidine-3,4-dicarboxylate;AC1NOHVO;AC1Q43YF;ACMC-2098z0;CTK8C4635;methyl 3-tert-butoxycarbonyl-2,2-dimethyloxazolidine-4-(R)-carboxylate;PubChem5661;SureCN313996;(S)-N-BOC-2,2-DIMETHYLOXAZOLINDINE-4-CARBOX YLIC ACID METHL ESTER;3-(1,1-DIMETHYLETHYL)-4-METHYL-(R,S)-2,2-DIMETHYL-3,4-OXAZOLIDINEDICARBOXYLATE;AKOS016007680;LS-14133;EN300-88561;3,4-Oxazolidinedicarboxylic acid, 2,2-dimethyl-, 3-(1,1-dimethylethyl) 4-methyl ester;PB43975;157604-46-1;3-(tert-butyl) 4-methyl 2,2-dimethyloxazolidine-3,4-dicarboxylate;3-tert-Butyl4-methyl2,2-dimethyloxazolidine-3,4-dicarboxylate;2,2-Dimethyloxazolidine-3,4-dicarboxylic acid 3-tert-butyl ester 4-methyl ester;NS00015761;SY031264;Methyl (S)-N-Boc-2,2-dimethyloxazolidine-4-carboxylate;MFCD06596212;3-O-tert-butyl 4-O-methyl 2,2-dimethyl-1,3-oxazolidine-3,4-dicarboxylate;Methyl N-Boc-2,2-dimethyloxazolidine-4-carboxylate;ZNBUXTFASGDVCL-UHFFFAOYSA-N;FT-0694670;2,2-Dimethyl-oxazolidine-3,4-dicarboxylic acid 3-tert-butyl ester 4-methyl ester;FT-0663930;DTXSID20408680;SCHEMBL313996;SY029646;PB39542;2,2-dimethyl-3,4-oxazolidinedicarboxylic acid 3-tert-butyl 4-methyl ester;A926888;FT-0774298;SY025054;F30852;5-PHENYLISOXAZOLE-3-CARBOXYLICACIDHYD&;METHYL 3-(TERT-BUTOXYCARBONYL)-2, 2-DIMETHYL-4-OXAZOLIDINECARBOXYLATE;3-(1,1-dimethylethyl)-4-methyl-(R,S)-2,2-dimethyl-3,4-oxazolidinedicarboxylate, 95 %;Methyl (R)-(+)-3-Boc-2,2-dimethyl-4-oxazolidinecarboxylate;3-(tert-butyl) 4-methyl (R)-2,2-dimethyloxazolidine-3,4-dicarboxylate;N-Boc-2,2-dimethyl-4-oxazolidinecarboxylic acid methyl ester;

标识符

MDL:
MFCD06596212
InChIKey:
ZNBUXTFASGDVCL-UHFFFAOYSA-N
Inchi:
1S/C12H21NO5/c1-11(2,3)18-10(15)13-8(9(14)16-6)7-17-12(13,4)5/h8H,7H2,1-6H3
SMILES:
O1CC(C(=O)OC)N(C(=O)OC(C)(C)C)C1(C)C

(S)-N-Boc-2,2-二甲基噁唑烷-4-羧酸甲酯(157604-46-1)物化性质

实验特性

  • PSA : 65.07
  • 折射率 : 1.474

计算特性

  • 精确分子量 : 259.14203
  • 氢键供体数量 : 0
  • 氢键受体数量 : 6
  • 可旋转化学键数量 : 5
  • 同位素质量 : 259.142
  • 重原子数量 : 18
  • 复杂度 : 345
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 1
  • 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 : 65.1A^2

(S)-N-Boc-2,2-二甲基噁唑烷-4-羧酸甲酯(157604-46-1)安全信息

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