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
3.0158 0.4790 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1438 -0.4927 -0.9588 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7850 -0.3154 -0.4442 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4154 0.8287 0.1755 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8217 1.0159 0.6553 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1283 2.2418 1.2904 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7176 0.0512 0.5213 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.3996 -1.1260 -0.0962 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1567 -1.2665 -0.5575 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.3863 -2.1252 -0.2161 N 0 0 0 0 0 0 0 0 0 0 0 0
4.0313 0.4120 -1.1699 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7427 1.4038 -0.3213 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4704 -1.3896 -1.4564 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4284 3.0315 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0363 2.2873 2.3299 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1349 -3.1191 -0.4224 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3946 -1.9167 -0.1053 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