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304861-41-4,MFCD04969052
Catalog No.:AA00307W

304861-41-4 | Methyl 4-[(e)-(2-mercapto-4-oxo-1,3-thiazol-5(4h)-ylidene)methyl]benzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$123.00   $86.00
- +
5g
95%
in stock  
$489.00   $343.00
- +
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Technical Information
Catalog Number:
AA00307W
Chemical Name:
Methyl 4-[(e)-(2-mercapto-4-oxo-1,3-thiazol-5(4h)-ylidene)methyl]benzoate
CAS Number:
304861-41-4
Molecular Formula:
C12H9NO3S2
Molecular Weight:
279.3348
MDL Number:
MFCD04969052
SMILES:
COC(=O)c1ccc(cc1)C=C1SC(=S)NC1=O
Properties
Computed Properties
 
Complexity:
412  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.6  

Literature
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Additional Info:
SDS
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Tags:304861-41-4 Molecular Formula|304861-41-4 MDL|304861-41-4 SMILES|304861-41-4 Methyl 4-[(e)-(2-mercapto-4-oxo-1,3-thiazol-5(4h)-ylidene)methyl]benzoate