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
3.1376 0.0426 -0.5292 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1850 -0.8578 -0.4124 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7920 -0.4255 -0.2644 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4952 0.8853 -0.2488 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.7873 1.2439 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1404 2.6264 -0.0912 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7493 0.3170 0.0062 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.4862 -1.0076 -0.0055 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1898 -1.3432 -0.1441 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.5078 -1.9924 0.1201 N 0 0 0 0 0 0 0 0 0 0 0 0
2.9026 1.0969 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1762 -0.2279 -0.6402 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4154 -1.9091 -0.4241 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3929 3.3426 0.0439 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1068 2.9563 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4174 -2.8448 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3260 -1.9026 0.7490 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