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Home Quinolines 5057-12-5
5057-12-5,MFCD01111799
Catalog No.:AA00DEH0

5057-12-5 | 4,6,7,8-TETRAHYDRO-1H,3H-QUINOLINE-2,5-DIONE

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$39.00   $27.00
- +
5g
98%
in stock  
$112.00   $78.00
- +
25g
98%
in stock  
$295.00   $206.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DEH0
Chemical Name:
4,6,7,8-TETRAHYDRO-1H,3H-QUINOLINE-2,5-DIONE
CAS Number:
5057-12-5
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
MDL Number:
MFCD01111799
SMILES:
O=C1CCC2=C(N1)CCCC2=O
NSC Number:
160504
Properties
Computed Properties
 
Complexity:
278  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
XLogP3:
-0.2  

Upstream Synthesis Route

[1]JournalofOrganicChemistry,1981,vol.46,#18,p.3719

[1]JournalofOrganicChemistry,1981,vol.46,#18,p.3719

[1]Patent:CN107337639,2017,A,.Locationinpatent:Paragraph0120;0127;0139;0150;0161;0171;0172;0183

[1]JournalofOrganicChemistry,1981,vol.46,#18,p.3719

[1]SyntheticCommunications,2013,vol.43,#22,p.3010-3019

Downstream Synthesis Route

[1]JournalofOrganicChemistry,1981,vol.46,p.3719

[1]JournalofOrganicChemistry,1981,vol.46,p.3719

[1]JournalofMedicinalChemistry,1986,vol.29,p.1-8

[2]JournalofMedicinalChemistry,1986,vol.29,p.1-8

[3]MedicinalChemistryResearch,2016,vol.25,p.596-608

[1]JournalofOrganicChemistry,1981,vol.46,p.3719

[2]Patent:CN107337639,2017,A.Locationinpatent:Paragraph0120;0125;0137;0148;0159;0169;0170;0181

[3]Patent:US5068334,1991,A

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS
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Tags:5057-12-5 Molecular Formula|5057-12-5 MDL|5057-12-5 SMILES|5057-12-5 4,6,7,8-TETRAHYDRO-1H,3H-QUINOLINE-2,5-DIONE