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
3.1559 -0.1521 -0.3622 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1116 -0.9382 -0.4637 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7500 -0.4979 -0.1792 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3146 -1.3077 -0.2852 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5753 -0.8719 -0.0137 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6991 -1.7321 -0.1271 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6925 0.4152 0.3662 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6661 1.2603 0.4867 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5555 0.7762 0.2061 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8681 2.6005 0.8917 N 0 0 0 0 0 0 0 0 0 0 0 0
4.1349 -0.5334 -0.5851 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9939 0.8707 -0.0522 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2298 -1.9824 -0.7746 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9469 -2.0830 -1.0731 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2991 -2.0425 0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7619 2.9047 1.2961 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1080 3.3134 0.7873 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