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
3.1246 -0.2102 -0.0127 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1149 -0.8794 -0.5125 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7411 -0.4496 -0.2773 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5141 0.6492 0.4635 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.7346 1.0987 0.7175 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8938 2.2707 1.5113 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7710 0.4092 0.2025 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5871 -0.6943 -0.5434 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3198 -1.1029 -0.7686 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.6413 -1.4489 -1.1035 N 0 0 0 0 0 0 0 0 0 0 0 0
2.9341 0.6757 0.5842 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1398 -0.5083 -0.1731 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3335 -1.7579 -1.1031 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1033 2.1776 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8012 3.2092 1.0732 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6052 -1.7423 -2.0874 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4448 -1.6967 -0.5024 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