Home Other Building Blocks 3-(2,6-difluorophenyl)-1H-1,2,4-triazol-5-amine

3-(2,6-difluorophenyl)-1H-1,2,4-triazol-5-amine

CAS No.:
1016713-07-7
Catalog Number:
AG01EJAG
Molecular Formula:
C8H6F2N4
Molecular Weight:
196.1568
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Product Description
Catalog Number:
AG01EJAG
Chemical Name:
3-(2,6-difluorophenyl)-1H-1,2,4-triazol-5-amine
CAS Number:
1016713-07-7
Molecular Formula:
C8H6F2N4
Molecular Weight:
196.1568
MDL Number:
MFCD20233578
IUPAC Name:
5-(2,6-difluorophenyl)-1H-1,2,4-triazol-3-amine
InChI:
InChI=1S/C8H6F2N4/c9-4-2-1-3-5(10)6(4)7-12-8(11)14-13-7/h1-3H,(H3,11,12,13,14)
InChI Key:
FVRLRDMAPXDEDB-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1c1n[nH]c(n1)N)F
Properties
Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.056g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
196.161g/mol
Monoisotopic Mass:
196.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties