Home Other Building Blocks 4-(1H-1,2,3-benzotriazol-1-yl)pyrimidin-2-amine

4-(1H-1,2,3-benzotriazol-1-yl)pyrimidin-2-amine

CAS No.:
1542059-06-2
Catalog Number:
AG01BGFC
Molecular Formula:
C10H8N6
Molecular Weight:
212.2107
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Product Description
Catalog Number:
AG01BGFC
Chemical Name:
4-(1H-1,2,3-benzotriazol-1-yl)pyrimidin-2-amine
CAS Number:
1542059-06-2
Molecular Formula:
C10H8N6
Molecular Weight:
212.2107
MDL Number:
MFCD23992098
IUPAC Name:
4-(benzotriazol-1-yl)pyrimidin-2-amine
InChI:
InChI=1S/C10H8N6/c11-10-12-6-5-9(13-10)16-8-4-2-1-3-7(8)14-15-16/h1-6H,(H2,11,12,13)
InChI Key:
UMUPYEIXIUWMBR-UHFFFAOYSA-N
SMILES:
Nc1nccc(n1)n1nnc2c1cccc2
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.081g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
212.216g/mol
Monoisotopic Mass:
212.081g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
82.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties