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
-1.4864 -2.7324 -0.2551 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7290 -1.4814 -0.5657 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7422 -0.4627 -0.2704 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9781 0.8193 -0.5827 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0602 1.7511 -0.3055 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3305 3.0974 -0.6439 N 0 0 0 0 0 0 0 0 0 0 0 0
1.1072 1.3939 0.2914 N 0 0 0 0 0 0 0 0 0 0 0 0
1.3651 0.1235 0.6121 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4286 -0.7872 0.3230 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5929 -0.2715 1.2430 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.1776 -3.5414 -0.4468 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5528 -3.0216 0.2229 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6481 -1.2070 -1.0346 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0427 3.4612 -1.5600 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8136 3.7006 0.0318 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7698 -1.2662 1.4239 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2976 0.4244 1.5165 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