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
3.1969 -0.1436 0.1545 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1661 -0.9453 0.2987 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7904 -0.4631 0.1351 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5284 0.8198 -0.1693 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.7477 1.2602 -0.3196 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0390 2.6101 -0.6404 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8013 0.4244 -0.1684 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5339 -0.8581 0.1361 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2684 -1.2912 0.2842 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.5896 -1.7918 0.3096 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2157 -0.4792 0.2707 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0122 0.8885 -0.0894 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3378 -1.9844 0.5436 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5658 2.8959 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7143 3.3922 -0.0045 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4817 -2.7820 -0.0057 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5057 -1.5522 0.7479 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