Home Other Building Blocks 5-(1-benzofuran-2-yl)-4H-1,2,4-triazol-3-amine

5-(1-benzofuran-2-yl)-4H-1,2,4-triazol-3-amine

CAS No.:
1016701-37-3
Catalog Number:
AG01BCUE
Molecular Formula:
C10H8N4O
Molecular Weight:
200.1967
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Product Description
Catalog Number:
AG01BCUE
Chemical Name:
5-(1-benzofuran-2-yl)-4H-1,2,4-triazol-3-amine
CAS Number:
1016701-37-3
Molecular Formula:
C10H8N4O
Molecular Weight:
200.1967
MDL Number:
MFCD09927721
IUPAC Name:
5-(1-benzofuran-2-yl)-1H-1,2,4-triazol-3-amine
InChI:
InChI=1S/C10H8N4O/c11-10-12-9(13-14-10)8-5-6-3-1-2-4-7(6)15-8/h1-5H,(H3,11,12,13,14)
InChI Key:
YDKHZCRYLLPPEJ-UHFFFAOYSA-N
SMILES:
Nc1nnc([nH]1)c1cc2c(o1)cccc2
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.07g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
200.201g/mol
Monoisotopic Mass:
200.07g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
80.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties