Monomers

Diallylcyanamide

Identifiers

IUPAC name
bis(prop-2-enyl)cyanamide
InchI
InChI=1S/C7H10N2/c1-3-5-9(7-8)6-4-2/h3-4H,1-2,5-6H2
InchI Key
ZOSAYFDMPYAZTB-UHFFFAOYSA-N
SMILES
C=CCN(C#N)CC=C
Canonical SMILES
C=CCN(CC=C)C#N
Isomeric SMILES
C=CCN(CC=C)C#N
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H10N2
Heavy Atom Count
9
Molecular Weight
122.171
Exact Molecular Weight
122.0844
Valence Electrons
48
Radical Electrons
0
tPSA
27.03
MolLogP
1.1415
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 19 18  0  0  0  0  0  0  0  0999 V2000
    3.1004    0.2651   -1.5045 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4803    0.3276   -0.3079 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3261   -0.4789   -0.1763 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0192   -0.2120    0.0672 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8832   -1.4466   -0.3306 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6586   -2.5225   -0.6906 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8482    0.7816    0.6616 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1212    0.3244    1.1234 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3462    0.4978    0.7003 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6724   -0.3719   -2.3436 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0151    0.7649   -1.5670 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9124    1.0030    0.4353 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6286   -1.1461    0.8944 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4347   -1.3430   -0.9330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7868    1.8121    0.2407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2555    0.9201    1.7306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0690   -0.4955    1.9845 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3172    1.1479   -0.2930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2647    0.1720    1.1129 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  3  0
  4  7  1  0
  7  8  1  0
  8  9  2  3
  1 10  1  0
  1 11  1  0
  2 12  1  0
  3 13  1  0
  3 14  1  0
  7 15  1  0
  7 16  1  0
  8 17  1  0
  9 18  1  0
  9 19  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers