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Home Thiazoles 1474053-20-7
1474053-20-7,MFCD20481929
Catalog No.:AA00IX7D

1474053-20-7 | 4-{[(5Z)-3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}benzoic acid

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Technical Information
Catalog Number:
AA00IX7D
Chemical Name:
4-{[(5Z)-3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}benzoic acid
CAS Number:
1474053-20-7
Molecular Formula:
C13H11NO3S2
Molecular Weight:
293.3613
MDL Number:
MFCD20481929
SMILES:
CCN1C(=S)S/C(=C\c2ccc(cc2)C(=O)O)/C1=O
Properties
Computed Properties
 
Complexity:
439  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.9  

Literature
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Additional Info:
SDS
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Tags:1474053-20-7 Molecular Formula|1474053-20-7 MDL|1474053-20-7 SMILES|1474053-20-7 4-{[(5Z)-3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}benzoic acid