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
3.0922 -0.4459 0.3524 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0872 -1.1495 -0.1291 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7637 -0.5403 -0.1045 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5447 0.6919 0.3849 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6632 1.2686 0.4163 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8879 2.5734 0.9358 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7057 0.5603 -0.0741 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5569 -0.6786 -0.5789 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3231 -1.2030 -0.5832 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.6640 -1.4100 -1.0906 N 0 0 0 0 0 0 0 0 0 0 0 0
2.9686 0.5495 0.7572 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1103 -0.8311 0.3693 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2855 -2.1291 -0.5138 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6053 3.2279 0.6173 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2623 2.9095 1.7243 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9181 -1.4993 -2.0914 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2658 -1.8942 -0.3921 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