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Home Amines 53994-69-7
53994-69-7,MFCD09039101
Catalog No.:AA00I9K3

53994-69-7 | (6R,7R)-7-amino-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
96%
in stock  
$24.00   $17.00
- +
250mg
96%
in stock  
$39.00   $28.00
- +
1g
96%
in stock  
$78.00   $55.00
- +
5g
97%
in stock  
$245.00   $171.00
- +
10g
96%
in stock  
$284.00   $199.00
- +
25g
97%
in stock  
$677.00   $474.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00I9K3
Chemical Name:
(6R,7R)-7-amino-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Number:
53994-69-7
Molecular Formula:
C7H7ClN2O3S
Molecular Weight:
234.6601
MDL Number:
MFCD09039101
SMILES:
O=C1[C@@H](N)[C@@H]2N1C(=C(CS2)Cl)C(=O)O
Properties
Computed Properties
 
Complexity:
357  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
-2.8  

Downstream Synthesis Route

[1]Tetrahedron,1992,vol.48,p.6853-6862

[1]JournalofMedicinalChemistry,1988,vol.31,p.1987-1993

[1]JournalofMedicinalChemistry,1988,vol.31,p.1987-1993

[1]JournalofMedicinalChemistry,1982,vol.25,p.457-469

[1]JournalofMedicinalChemistry,1988,vol.31,p.1987-1993

Literature

Title: Xiaoling Wu, et al. Improving Biocatalysis of Cefaclor With Penicillin Acylase Immobilized on Magnetic Nanocrystalline Cellulose in Deep Eutectic Solvent Based Co-Solvent. Bioresour Technol. 2019 Sep;288:121548.

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SDS
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Tags:53994-69-7 Molecular Formula|53994-69-7 MDL|53994-69-7 SMILES|53994-69-7 (6R,7R)-7-amino-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid