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
2.9774 -0.8110 -0.2949 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3319 0.3185 -0.2091 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8676 0.2915 -0.0753 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1550 1.4238 0.0169 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.1767 1.3290 0.1369 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9436 2.5252 0.2356 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8100 0.1228 0.1665 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0976 -1.0096 0.0743 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2340 -0.8891 -0.0451 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6888 -2.3071 0.0979 N 0 0 0 0 0 0 0 0 0 0 0 0
2.4916 -1.7665 -0.2728 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0472 -0.7968 -0.3928 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8567 1.2726 -0.2349 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4146 2.7683 1.1176 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0252 3.1474 -0.5807 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4661 -2.9605 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3389 -2.6586 -0.6313 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