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
3.1273 0.6321 -0.1141 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3476 -0.4051 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8992 -0.2709 0.0747 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2690 0.9169 0.0328 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0510 1.0906 0.0979 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6988 2.3500 0.0523 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8079 -0.0380 0.2163 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2264 -1.2450 0.2622 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1078 -1.3707 0.1932 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.0425 -2.3995 0.3858 N 0 0 0 0 0 0 0 0 0 0 0 0
2.7313 1.6343 -0.1573 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1817 0.5182 -0.1678 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7810 -1.3912 0.0396 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3655 3.1875 0.5665 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5581 2.4614 -0.5233 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3156 -2.9199 -0.4876 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3792 -2.7508 1.2902 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