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18698-73-2,MFCD03701554
Catalog No.:AA003I6K

18698-73-2 | 3-(Methylthio)phenylacetic acid

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Purity
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Price(USD)
Quantity
  
250mg
95%
in stock  
$42.00   $29.00
- +
1g
95%
in stock  
$79.00   $55.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003I6K
Chemical Name:
3-(Methylthio)phenylacetic acid
CAS Number:
18698-73-2
Molecular Formula:
C9H10O2S
Molecular Weight:
182.2395
MDL Number:
MFCD03701554
SMILES:
CSc1cccc(c1)CC(=O)O
Properties
Properties
 
BP:
333.7°C at 760 mmHg  
Form:
Solid  
MP:
77-81°C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
159  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.2  

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,1993,vol.36,p.2279-2291

[1]Patent:EP1199307,2002,A1.Locationinpatent:Page14

Literature
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SDS
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