Monomers

1-Ethenyl-3-ethylurea

Identifiers

IUPAC name
1-ethenyl-3-ethylurea
InchI
InChI=1S/C5H10N2O/c1-3-6-5(8)7-4-2/h3H,1,4H2,2H3,(H2,6,7,8)
InchI Key
LIOYFPXDFZHOGN-UHFFFAOYSA-N
SMILES
CCNC(=O)NC=C
Canonical SMILES
CCNC(=O)NC=C
Isomeric SMILES
CCNC(=O)NC=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H10N2O
Heavy Atom Count
8
Molecular Weight
114.148
Exact Molecular Weight
114.0793
Valence Electrons
46
Radical Electrons
0
tPSA
41.13
MolLogP
0.449
H Bond Acceptors
1
H Bond Donors
2
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 18 17  0  0  0  0  0  0  0  0999 V2000
    2.3812    0.7009   -1.0505 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0321   -0.7182   -0.7214 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0358   -0.8568    0.2912 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2792   -0.2948    0.1041 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4742    0.2960   -0.9612 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2861   -0.4101    1.0768 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6010    0.1039    0.9878 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1098    0.7707   -0.0034 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3245    0.9366   -0.4742 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6207    1.4348   -0.7047 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5768    0.8112   -2.1232 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9192   -1.3164   -0.4149 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6634   -1.1967   -1.6589 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1948   -1.3539    1.1914 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0204   -0.9394    1.9648 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2580   -0.0825    1.8499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1599    1.1041    0.0832 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5599    1.0106   -0.8964 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  2  3
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  3 14  1  0
  6 15  1  0
  7 16  1  0
  8 17  1  0
  8 18  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers