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
3.1440 -0.1215 0.3556 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1270 -0.8809 0.6524 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7639 -0.4501 0.3059 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3078 -1.1858 0.5855 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5771 -0.7989 0.2701 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6902 -1.6180 0.5887 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7549 0.3812 -0.3527 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6841 1.1499 -0.6494 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5706 0.7262 -0.3164 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8849 2.3899 -1.3050 N 0 0 0 0 0 0 0 0 0 0 0 0
3.0442 0.8320 -0.1435 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1483 -0.4320 0.6074 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2382 -1.8166 1.1434 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0511 -2.2408 -0.1604 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1703 -1.6431 1.5087 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2835 2.4323 -2.2609 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6324 3.2761 -0.8297 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