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123040-79-9,MFCD09031399
Catalog No.:AA000JWT

123040-79-9 | 6-Chloro-3,4-dihydro-4-methyl-3-oxo-2h-1,4-benzoxanine-8-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
1 week  
$33.00   $23.00
- +
1g
95%
1 week  
$87.00   $61.00
- +
5g
95%
1 week  
$303.00   $212.00
- +
  • 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:
AA000JWT
Chemical Name:
6-Chloro-3,4-dihydro-4-methyl-3-oxo-2h-1,4-benzoxanine-8-carboxylic acid
CAS Number:
123040-79-9
Molecular Formula:
C10H8ClNO4
Molecular Weight:
241.6278
MDL Number:
MFCD09031399
SMILES:
Clc1cc2N(C)C(=O)COc2c(c1)C(=O)O
Properties
Computed Properties
 
Complexity:
322  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.2  

Upstream Synthesis Route

[1]Patent:CN104557907,2016,B,.Locationinpatent:Paragraph0015;0079;0080

[2]Patent:CN103351386,2016,B,.Locationinpatent:Paragraph0015;0028;0029

[3]ChemicalandPharmaceuticalBulletin,1992,vol.40,#3,p.624-630

[1]ChemicalandPharmaceuticalBulletin,1992,vol.40,#3,p.624-630

[1]ChemicalandPharmaceuticalBulletin,1992,vol.40,#3,p.624-630

[1]ChemicalandPharmaceuticalBulletin,1992,vol.40,#3,p.624-630

[1]ChemicalandPharmaceuticalBulletin,1992,vol.40,#3,p.624-630

Downstream Synthesis Route

[1]ChemicalandPharmaceuticalBulletin,1992,vol.40,p.624-630

[1]ChemicalandPharmaceuticalBulletin,1992,vol.40,p.624-630

[1]ChemicalandPharmaceuticalBulletin,1992,vol.40,p.624-630

[1]ChemicalandPharmaceuticalBulletin,1992,vol.40,p.624-630

[2]ChemicalandPharmaceuticalBulletin,1995,vol.43,p.1912-1930

[1]Patent:CN110563721,2019,A.Locationinpatent:Paragraph0028;0049-0050

[2]Patent:CN104557907,2016,B.Locationinpatent:Paragraph0015;0079;0080

[3]Patent:CN103351386,2016,B.Locationinpatent:Paragraph0015;0028;0029

[4]ChemicalandPharmaceuticalBulletin,1992,vol.40,p.624-630

Literature
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SDS
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Tags:123040-79-9 Molecular Formula|123040-79-9 MDL|123040-79-9 SMILES|123040-79-9 6-Chloro-3,4-dihydro-4-methyl-3-oxo-2h-1,4-benzoxanine-8-carboxylic acid