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
2.8437 -1.2250 -0.4571 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2870 -0.0693 -0.7437 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8837 0.1131 -0.3446 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2073 -0.8607 0.2839 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0618 -0.7562 0.6697 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7390 -1.8275 1.3385 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6968 0.3913 0.4128 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0610 1.3951 -0.2144 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2193 1.2572 -0.5902 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8029 2.6043 -0.4606 N 0 0 0 0 0 0 0 0 0 0 0 0
2.2756 -1.9853 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8710 -1.3732 -0.7433 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8314 0.7222 -1.2526 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5564 -1.9762 2.3494 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3950 -2.4164 0.7642 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7272 3.0543 -1.3836 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3788 2.9524 0.3248 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