913388-66-6,MFCD11616305
Catalog No.:AA006NP7

913388-66-6 | 1H-Indole-1-carboxylic acid, 2-borono-5-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1-(1,1-dimethylethyl) ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$524.00   $367.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA006NP7
Chemical Name:
1H-Indole-1-carboxylic acid, 2-borono-5-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1-(1,1-dimethylethyl) ester
CAS Number:
913388-66-6
Molecular Formula:
C18H25BN2O6
Molecular Weight:
376.2119
MDL Number:
MFCD11616305
SMILES:
O=C(OC(C)(C)C)Nc1ccc2c(c1)cc(n2C(=O)OC(C)(C)C)B(O)O
Properties
Properties
 
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
557  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Downstream Synthesis Route

[1]Patent:WO2010/111483,2010,A1.Locationinpatent:Page/Pagecolumn98

[2]Patent:US2019/127365,2019,A1.Locationinpatent:Paragraph0680-0681

[1]Patent:WO2010/111483,2010,A1.Locationinpatent:Page/Pagecolumn109

[2]Patent:US2019/127365,2019,A1.Locationinpatent:Paragraph0705-0706

[1]Patent:WO2010/111483,2010,A1.Locationinpatent:Page/Pagecolumn130

[2]Patent:US2019/127365,2019,A1.Locationinpatent:Paragraph0827-0828

[1]Patent:WO2010/111483,2010,A1.Locationinpatent:Page/Pagecolumn93

[2]Patent:US2019/127365,2019,A1.Locationinpatent:Paragraph0650-0651

Literature
Quotation Request
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Additional Info:
SDS
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Tags:913388-66-6 Molecular Formula|913388-66-6 MDL|913388-66-6 SMILES|913388-66-6 1H-Indole-1-carboxylic acid, 2-borono-5-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1-(1,1-dimethylethyl) ester
Catalog No.: AA006NP7
913388-66-6,MFCD11616305
913388-66-6 | 1H-Indole-1-carboxylic acid, 2-borono-5-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1-(1,1-dimethylethyl) ester
Pack Size: 250mg
Purity: 95%
in stock
$524.00 $367.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA006NP7
Chemical Name: 1H-Indole-1-carboxylic acid, 2-borono-5-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1-(1,1-dimethylethyl) ester
CAS Number: 913388-66-6
Molecular Formula: C18H25BN2O6
Molecular Weight: 376.2119
MDL Number: MFCD11616305
SMILES: O=C(OC(C)(C)C)Nc1ccc2c(c1)cc(n2C(=O)OC(C)(C)C)B(O)O
Properties
Storage: Inert atmosphere;2-8℃;  
Complexity: 557  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 27  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 3  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
Downstream Synthesis Route
56621-90-0    913388-66-6    1246471-22-6 

[1]Patent:WO2010/111483,2010,A1.Locationinpatent:Page/Pagecolumn98

[2]Patent:US2019/127365,2019,A1.Locationinpatent:Paragraph0680-0681

1007882-39-4    913388-66-6    1246471-28-2 

[1]Patent:WO2010/111483,2010,A1.Locationinpatent:Page/Pagecolumn109

[2]Patent:US2019/127365,2019,A1.Locationinpatent:Paragraph0705-0706

1031747-50-8    913388-66-6    1246471-75-9 

[1]Patent:WO2010/111483,2010,A1.Locationinpatent:Page/Pagecolumn130

[2]Patent:US2019/127365,2019,A1.Locationinpatent:Paragraph0827-0828

913388-66-6    1246471-11-3    1246471-12-4 

[1]Patent:WO2010/111483,2010,A1.Locationinpatent:Page/Pagecolumn93

[2]Patent:US2019/127365,2019,A1.Locationinpatent:Paragraph0650-0651

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