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87736-89-8,MFCD01075064
Catalog No.:AA00GWGU

87736-89-8 | 2,5-Dioxopyrrolidin-1-yl 4-(3-(trifluoromethyl)-3H-diazirin-3-yl)benzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
1 week  
$128.00   $90.00
- +
250mg
97%
1 week  
$216.00   $152.00
- +
1g
97%
1 week  
$583.00   $408.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00GWGU
Chemical Name:
2,5-Dioxopyrrolidin-1-yl 4-(3-(trifluoromethyl)-3H-diazirin-3-yl)benzoate
CAS Number:
87736-89-8
Molecular Formula:
C13H8F3N3O4
Molecular Weight:
327.2155
MDL Number:
MFCD01075064
SMILES:
O=C(c1ccc(cc1)C1(N=N1)C(F)(F)F)ON1C(=O)CCC1=O
Properties
Computed Properties
 
Complexity:
560  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
9  
Rotatable Bond Count:
4  
XLogP3:
1.9  

Downstream Synthesis Route

[1]Heterocycles,1996,vol.43,p.519-522

[2]ACSChemicalBiology,2018,vol.13,p.1380-1387

[3]LiebigsAnnalenderChemie,1983,p.1510-1523

[4]Synthesis,2012,vol.44,p.2249-2254

[5]Patent:US2012/322978,2012,A1.Locationinpatent:Page/Pagecolumn15

[6]Patent:WO2013/12961,2013,A2.Locationinpatent:Paragraph00354;00355;00359

[7]Patent:WO2019/167973,2019,A1.Locationinpatent:Paragraph0080

57260-73-8    87736-89-8   
N-<4-<3-(trifluoromethyl)-3H-diazirin-3-yl>benzoyl>-N'-(tert-butoxycarbonyl)ethylenediamine 

[1]Heterocycles,1993,vol.35,p.997-1004

[1]ChemicalandPharmaceuticalBulletin,1991,vol.39,p.1860-1862

[1]LiebigsAnnalenderChemie,1983,vol.NO.9,p.1533-1540

[1]LiebigsAnnalenderChemie,1983,vol.NO.9,p.1533-1540

Literature
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SDS
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Tags:87736-89-8 Molecular Formula|87736-89-8 MDL|87736-89-8 SMILES|87736-89-8 2,5-Dioxopyrrolidin-1-yl 4-(3-(trifluoromethyl)-3H-diazirin-3-yl)benzoate