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1250998-27-6,MFCD17016829
Catalog No.:AA019EQW

1250998-27-6 | Tert-Butyl Hexahydro-1H-3A,7-Epoxypyrrolo[3,4-C]Azepine-5(4H)-Carboxylate

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Technical Information
Catalog Number:
AA019EQW
Chemical Name:
Tert-Butyl Hexahydro-1H-3A,7-Epoxypyrrolo[3,4-C]Azepine-5(4H)-Carboxylate
CAS Number:
1250998-27-6
Molecular Formula:
C13H22N2O3
Molecular Weight:
254.3254
MDL Number:
MFCD17016829
SMILES:
O=C(N1CC2CC3C(C1)(O2)CNC3)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
366  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
3  
XLogP3:
0.4  

Literature
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SDS
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Tags:1250998-27-6 Molecular Formula|1250998-27-6 MDL|1250998-27-6 SMILES|1250998-27-6 Tert-Butyl Hexahydro-1H-3A,7-Epoxypyrrolo[3,4-C]Azepine-5(4H)-Carboxylate