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1052680-53-1,MFCD09756545
Catalog No.:AA003SQG

1052680-53-1 | N-Boc-3-methylmorpholine-3-carboxylic acid

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Purity
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Price(USD)
Quantity
  
100mg
95%
in stock  
$145.00   $102.00
- +
250mg
95%
in stock  
$278.00   $195.00
- +
1g
95%
in stock  
$652.00   $457.00
- +
5g
95%
in stock  
$1,636.00   $1,145.00
- +
  • Technical Information
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003SQG
Chemical Name:
N-Boc-3-methylmorpholine-3-carboxylic acid
CAS Number:
1052680-53-1
Molecular Formula:
C11H19NO5
Molecular Weight:
245.2723
MDL Number:
MFCD09756545
SMILES:
O=C(N1CCOCC1(C)C(=O)O)OC(C)(C)C
Properties
Properties
 
Storage:
2-8℃;  

Computed Properties
 
Complexity:
322  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
0.6  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2014/37480,2014,A1Locationinpatent:Page/Pagecolumn122;123

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-US2015/31687,2015,A1Locationinpatent:Paragraph0428;0429

1052680-53-1    76-05-1   
C6H11NO3*C2HF3O2 

[1]Qiu,Zongxing;Lin,Xianfeng;Zhang,Weixing;Zhou,Mingwei;Guo,Lei;Kocer,Buelent;Wu,Guolong;Zhang,Zhisen;Liu,Haixia;Shi,Houguang;Kou,Buyu;Hu,Taishan;Hu,Yimin;Huang,Mengwei;Yan,S.Frank;Xu,Zhiheng;Zhou,Zheng;Qin,Ning;Wang,YueFen;Ren,Shuang;Qiu,Hongxia;Zhang,Yuxia;Zhang,Yi;Wu,Xiaoyue;Sun,Kai;Zhong,Sheng;Xie,Jianxun;Ottaviani,Giorgio;Zhou,Yuan;Zhu,Lina;Tian,Xiaojun;Shi,Liping;Shen,Fang;Mao,Yi;Zhou,Xue;Gao,Lu;Young,JohnA.T.;Wu,JimZhen;Yang,Guang;Mayweg,AlexanderV.;Shen,HongC.;Tang,Guozhi;Zhu,Wei[JournalofMedicinalChemistry,2017,vol.60,#8,p.3352-3371]

1052680-53-1    1578155-50-6   
(3R)-4-(4R)-4-(2-chloro-4-fluoro-phenyl)-5-methoxycarbonyl-2-thiazol-2-yl-1,4-dihydropyrimidin-6-ylmethyl-3-methyl-morpholine-3-carboxylicacid 

[1]Qiu,Zongxing;Lin,Xianfeng;Zhang,Weixing;Zhou,Mingwei;Guo,Lei;Kocer,Buelent;Wu,Guolong;Zhang,Zhisen;Liu,Haixia;Shi,Houguang;Kou,Buyu;Hu,Taishan;Hu,Yimin;Huang,Mengwei;Yan,S.Frank;Xu,Zhiheng;Zhou,Zheng;Qin,Ning;Wang,YueFen;Ren,Shuang;Qiu,Hongxia;Zhang,Yuxia;Zhang,Yi;Wu,Xiaoyue;Sun,Kai;Zhong,Sheng;Xie,Jianxun;Ottaviani,Giorgio;Zhou,Yuan;Zhu,Lina;Tian,Xiaojun;Shi,Liping;Shen,Fang;Mao,Yi;Zhou,Xue;Gao,Lu;Young,JohnA.T.;Wu,JimZhen;Yang,Guang;Mayweg,AlexanderV.;Shen,HongC.;Tang,Guozhi;Zhu,Wei[JournalofMedicinalChemistry,2017,vol.60,#8,p.3352-3371]

Literature
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SDS
Tags:1052680-53-1 Molecular Formula|1052680-53-1 MDL|1052680-53-1 SMILES|1052680-53-1 N-Boc-3-methylmorpholine-3-carboxylic acid