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
3.0710 0.6754 -0.1984 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3514 -0.4061 -0.0757 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9044 -0.3009 -0.0163 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1177 -1.3831 0.1097 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2232 -1.2944 0.1655 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0635 -2.4272 0.2982 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7831 -0.0506 0.0896 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0311 1.0552 -0.0367 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2975 0.9055 -0.0869 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6573 2.3463 -0.1135 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6023 1.6320 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1378 0.6036 -0.2427 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8040 -1.3739 -0.0175 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8489 -2.5493 -0.3573 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8749 -3.1064 1.0452 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5448 3.0722 0.6195 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2595 2.6018 -0.9278 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