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
cid=

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
    3.1164   -0.4315   -0.4137 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0315   -1.1722   -0.3522 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7099   -0.5866   -0.2000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5748    0.7426   -0.1186 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6351    1.3392    0.0238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6506    2.7633    0.0991 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7215    0.5802    0.0846 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6396   -0.7665    0.0072 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4134   -1.3229   -0.1346 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8144   -1.5598    0.0744 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0806    0.6584   -0.3539 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0937   -0.8733   -0.5267 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1315   -2.2393   -0.4168 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1558    3.2666    0.5229 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4672    3.3004   -0.2693 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8135   -2.5602    0.3486 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7389   -1.1384   -0.1592 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