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30452-55-2,MFCD02366325
Catalog No.:AA00303G

30452-55-2 | 2-((5-(Furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetic acid

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Technical Information
Catalog Number:
AA00303G
Chemical Name:
2-((5-(Furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetic acid
CAS Number:
30452-55-2
Molecular Formula:
C8H7N3O3S
Molecular Weight:
225.2245
MDL Number:
MFCD02366325
SMILES:
OC(=O)CSc1[nH]nc(n1)c1ccco1
NSC Number:
634485
Properties
Computed Properties
 
Complexity:
241  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
XLogP3:
1.2  

Literature
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Additional Info:
SDS
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Tags:30452-55-2 Molecular Formula|30452-55-2 MDL|30452-55-2 SMILES|30452-55-2 2-((5-(Furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetic acid