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
3.1721 0.2761 0.1152 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2386 -0.6084 0.3605 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8203 -0.3163 0.1178 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4289 0.8546 -0.3591 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8891 1.1027 -0.5758 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3383 2.3637 -1.0920 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8095 0.1598 -0.3075 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.4012 -1.0277 0.1772 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0978 -1.2457 0.3813 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.3483 -2.0469 0.4717 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2016 0.0569 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8958 1.2348 -0.2713 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5292 -1.5706 0.7496 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2442 2.5532 -2.0983 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7599 3.1015 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3698 -1.9085 0.3758 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0284 -2.9792 0.7987 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