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
3.1499 0.1603 0.3629 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2488 -0.7564 0.0633 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8340 -0.4213 -0.0086 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1063 -1.3217 -0.3084 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.4207 -1.0492 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3988 -2.0127 -0.7019 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7865 0.2398 -0.1328 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8771 1.1888 0.1747 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4050 0.8415 0.2301 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2938 2.5121 0.4283 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2060 -0.0626 0.4228 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8490 1.1812 0.5609 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5880 -1.7585 -0.1265 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5835 -2.7873 -0.0495 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9252 -1.9403 -1.5835 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2579 2.8798 1.3913 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6307 3.1063 -0.3392 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