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193151-97-2,MFCD03426480
Catalog No.:AA00APL5

193151-97-2 | 4-(3,4-Methylenedioxyphenyl)benzoic acid

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00APL5
Chemical Name:
4-(3,4-Methylenedioxyphenyl)benzoic acid
CAS Number:
193151-97-2
Molecular Formula:
C14H10O4
Molecular Weight:
242.2268
MDL Number:
MFCD03426480
SMILES:
OC(=O)c1ccc(cc1)c1ccc2c(c1)OCO2
Properties
Computed Properties
 
Complexity:
309  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
3.1  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ABBVIEINC-US2002/55631,2002,A1

[2]CurrentPatentAssignee:ABBVIEINC-US2002/86887,2002,A1

[1]Schöffmann,Angela;Wimmer,Laurin;Goldmann,Daria;Khom,Sophia;Hintersteiner,Juliane;Baburin,Igor;Schwarz,Thomas;Hintersteininger,Michael;Pakfeifer,Peter;Oufir,Mouhssin;Hamburger,Matthias;Erker,Thomas;Ecker,GerhardF.;Mihovilovic,MarkoD.;Hering,Steffen[JournalofMedicinalChemistry,2014,vol.57,#13,p.5602-5619]

[1]Schöffmann,Angela;Wimmer,Laurin;Goldmann,Daria;Khom,Sophia;Hintersteiner,Juliane;Baburin,Igor;Schwarz,Thomas;Hintersteininger,Michael;Pakfeifer,Peter;Oufir,Mouhssin;Hamburger,Matthias;Erker,Thomas;Ecker,GerhardF.;Mihovilovic,MarkoD.;Hering,Steffen[JournalofMedicinalChemistry,2014,vol.57,#13,p.5602-5619]

[1]CurrentPatentAssignee:ASTELLASPHARMAINC.-US2014/249151,2014,A1

193151-97-2    1431308-17-6   
C29H31N3O5 

[1]CurrentPatentAssignee:ASTELLASPHARMAINC.-US2014/249151,2014,A1Locationinpatent:Paragraph0241

Literature
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SDS
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