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
    2.8250    0.0086    1.9545 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6733   -0.7644    1.3583 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7824    0.1279    0.6468 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3641   -0.4283    0.0173 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6056   -1.6608    0.0721 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2647    0.4154   -0.6922 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4237   -0.0704   -1.3413 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2100    0.7660   -1.9775 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2963    0.6416    1.1692 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4665    0.6979    2.7369 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5131   -0.7107    2.4158 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0056   -1.5338    0.6643 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0927   -1.2026    2.2009 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9962    1.1649    0.6073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0426    1.4319   -0.7228 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6860   -1.1244   -1.3298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1041    0.4305   -2.4849 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9505    1.8106   -1.9892 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