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95903-37-0,MFCD03661530
Catalog No.:AA00J8EQ

95903-37-0 | methyl (7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate

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100mg
95%
1 week  
$120.00   $84.00
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250mg
95%
1 week  
$205.00   $144.00
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1g
95%
1 week  
$552.00   $387.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00J8EQ
Chemical Name:
methyl (7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate
CAS Number:
95903-37-0
Molecular Formula:
C13H12O5
Molecular Weight:
248.2314
MDL Number:
MFCD03661530
SMILES:
COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)O
Properties
Computed Properties
 
Complexity:
398  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.3  

Downstream Synthesis Route

[1]Locationinpatent:experimentalpartBorgatti,Monica;Chilin,Adriana;Piccagli,Laura;Lampronti,Ilaria;Bianchi,Nicoletta;Mancini,Irene;Marzaro,Giovanni;FrancescoDall'Acqua;Guiotto,Adriano;Gambari,Roberto[EuropeanJournalofMedicinalChemistry,2011,vol.46,#10,p.4870-4877]

[2]Nagorichna;Dubovik;Garazd;Khilya[ChemistryofNaturalCompounds,2003,vol.39,#3,p.253-261]

[1]Nagorichna;Dubovik;Garazd;Khilya[ChemistryofNaturalCompounds,2003,vol.39,#3,p.253-261]

[1]Nagorichna;Dubovik;Garazd;Khilya[ChemistryofNaturalCompounds,2003,vol.39,#3,p.253-261]

[1]Nagorichna;Dubovik;Garazd;Khilya[ChemistryofNaturalCompounds,2003,vol.39,#3,p.253-261]

[1]Nagorichna;Dubovik;Garazd;Khilya[ChemistryofNaturalCompounds,2003,vol.39,#3,p.253-261]

[2]Melis,Claudia;Distinto,Simona;Bianco,Giulia;Meleddu,Rita;Cottiglia,Filippo;Fois,Benedetta;Taverna,Domenico;Angius,Rossella;Alcaro,Stefano;Ortuso,Francesco;Gaspari,Marco;Angeli,Andrea;DelPrete,Sonia;Capasso,Clemente;Supuran,ClaudiuT.;Maccioni,Elias[ACSMedicinalChemistryLetters,2018,vol.9,#7,p.725-729]

[3]CurrentPatentAssignee:NANKAIUNIVERSITY-CN113929696,2022,ALocationinpatent:Paragraph0077-0079

[4]CurrentPatentAssignee:NANKAIUNIVERSITY-CN113929694,2022,ALocationinpatent:Paragraph0073-0075

[5]Dong,Jingyue;Gao,Wei;Li,Kun;Hong,Zeyu;Tang,Liangfu;Han,Lijun;Wang,Zhihong;Fan,Zhijin[JournalofAgriculturalandFoodChemistry,2022,vol.70,#11,p.3435-3446]Chen,Lai;Chen,Lei;Dong,Jingyue;Fan,Zhijin;Han,Lijun;Hong,Zeyu;Li,Kun;Tang,Liangfu[MolecularDiversity,2022]

Literature
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SDS
Tags:95903-37-0 Molecular Formula|95903-37-0 MDL|95903-37-0 SMILES|95903-37-0 methyl (7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate