Monomers
2-Vinyl-4,6-diamino-1,3,5-triazine
Identifiers
IUPAC name
6-ethenyl-1,3,5-triazine-2,4-diamine
InchI
InChI=1S/C5H7N5/c1-2-3-8-4(6)10-5(7)9-3/h2H,1H2,(H4,6,7,8,9,10)
InchI Key
ZXLYUNPVVODNRE-UHFFFAOYSA-N
SMILES
C=Cc1nc(N)nc(n1)N
Canonical SMILES
C=CC1=NC(=NC(=N1)N)N
Isomeric SMILES
C=CC1=NC(=NC(=N1)N)N
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7N5
Heavy Atom Count
10
Molecular Weight
137.146
Exact Molecular Weight
137.0701
Valence Electrons
52
Radical Electrons
0
tPSA
90.71
MolLogP
-0.321
H Bond Acceptors
5
H Bond Donors
2
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
1
Aliphatic Rings
0
Aromatic Rings
1
MOL File
RDKit 3D
17 17 0 0 0 0 0 0 0 0999 V2000
3.1488 0.0885 -0.0852 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1758 0.9364 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7790 0.4982 -0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2496 1.3201 -0.3802 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5181 0.9071 -0.2362 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6295 1.7675 -0.4658 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7458 -0.3634 0.1380 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.7543 -1.2280 0.3711 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5072 -0.7638 0.2123 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.9821 -2.5829 0.7698 N 0 0 0 0 0 0 0 0 0 0 0 0
4.1752 0.3984 -0.1947 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9731 -0.9305 0.2149 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3845 1.9478 -0.6125 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5606 1.5492 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5704 2.6341 -1.0434 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8185 -2.8663 1.3311 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3147 -3.3122 0.5058 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 2 0
4 5 1 0
5 6 1 0
5 7 2 0
7 8 1 0
8 9 2 0
8 10 1 0
9 3 1 0
1 11 1 0
1 12 1 0
2 13 1 0
6 14 1 0
6 15 1 0
10 16 1 0
10 17 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers