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
2.7008 -1.6129 0.3059 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2961 -0.3685 0.3232 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9145 0.0047 0.0674 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0243 -0.9705 -0.1963 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2750 -0.6798 -0.4418 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2074 -1.7163 -0.7191 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6946 0.6122 -0.4237 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8157 1.6011 -0.1613 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4794 1.2677 0.0799 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2591 2.9526 -0.1433 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7345 -1.8470 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0457 -2.4354 0.1034 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9864 0.4373 0.5316 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2068 -1.5927 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9060 -2.5962 -1.1908 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7329 3.6618 -0.6969 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0842 3.2821 0.3930 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