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
3.1973 0.2586 -0.2965 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2793 -0.6869 -0.3555 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8434 -0.3669 -0.2913 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0850 -1.3371 -0.3521 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.4047 -1.0872 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3901 -2.1108 -0.3610 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8481 0.1765 -0.1759 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.9160 1.1492 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4101 0.9006 -0.1702 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.3060 2.5138 0.0136 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2387 -0.0075 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8502 1.2770 -0.1991 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5741 -1.7181 -0.4528 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1846 -3.0161 -0.8347 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3239 -1.9883 0.0541 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1134 2.7468 0.6309 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8214 3.2964 -0.4820 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