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28995-22-4,MFCD02094263
Catalog No.:AA002V2O

28995-22-4 | 3-(4-Mercaptophenyl)acrylic acid

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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:
AA002V2O
Chemical Name:
3-(4-Mercaptophenyl)acrylic acid
CAS Number:
28995-22-4
Molecular Formula:
C9H8O2S
Molecular Weight:
180.2236
MDL Number:
MFCD02094263
SMILES:
OC(=O)C=Cc1ccc(cc1)S
Properties
Properties
 
Form:
Solid  
MP:
217-218°C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
181  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
Undefined Bond Stereocenter Count:
1  
XLogP3:
2  

Downstream Synthesis Route

[1]Campaigne;Meyer[JournalofOrganicChemistry,1962,vol.27,p.2835,2841]

[1]Campaigne;Meyer[JournalofOrganicChemistry,1962,vol.27,p.2835,2841]

28995-22-4    107-07-3   
(E)-3-4-(2-Hydroxy-ethylsulfanyl)-phenyl-acrylicacid 

[1]Cozzi,Paolo;Beria,Italo;Caldarelli,Marina;Capolongo,Laura;Geroni,Cristina;Mazzini,Stefania;Ragg,Enzio[BioorganicandMedicinalChemistryLetters,2000,vol.10,#15,p.1653-1656]

Literature
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SDS
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