Home Other Building Blocks 6-PHENYL-1,2,4-TRIAZIN-3-AMINE

6-PHENYL-1,2,4-TRIAZIN-3-AMINE

CAS No.:
942-72-3
Catalog Number:
AG01DWW7
Molecular Formula:
C9H8N4
Molecular Weight:
172.1866
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Product Description
Catalog Number:
AG01DWW7
Chemical Name:
6-PHENYL-1,2,4-TRIAZIN-3-AMINE
CAS Number:
942-72-3
Molecular Formula:
C9H8N4
Molecular Weight:
172.1866
MDL Number:
MFCD00709181
IUPAC Name:
6-phenyl-1,2,4-triazin-3-amine
InChI:
InChI=1S/C9H8N4/c10-9-11-6-8(12-13-9)7-4-2-1-3-5-7/h1-6H,(H2,10,11,13)
InChI Key:
NIJQGEJYKLRADI-UHFFFAOYSA-N
SMILES:
Nc1ncc(nn1)c1ccccc1
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.075g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.191g/mol
Monoisotopic Mass:
172.075g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties