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
-1.6537 2.5406 0.6723 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4214 2.1257 0.8215 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0414 0.8303 0.2541 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2203 0.3503 0.3778 N 0 0 0 0 0 0 0 0 0 0 0 0
1.5969 -0.8372 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9093 -1.3496 -0.0123 N 0 0 0 0 0 0 0 0 0 0 0 0
0.6759 -1.5886 -0.8032 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.5853 -1.1401 -0.9432 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9109 0.0529 -0.4134 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5936 -1.8600 -1.6218 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.3957 1.9548 0.1435 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9468 3.4839 1.0806 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2625 2.7549 1.3558 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4679 -1.1665 0.8376 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3287 -1.9136 -0.7692 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6016 -1.8539 -2.6559 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3111 -2.3839 -1.0929 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