Monomers

Ethyl 2-ethoxyprop-2-enoate

Identifiers

IUPAC name
ethyl 2-ethoxyprop-2-enoate
InchI
InChI=1S/C7H12O3/c1-4-9-6(3)7(8)10-5-2/h3-5H2,1-2H3
InchI Key
WXMSGMOIAQWILS-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)OCC
Canonical SMILES
CCOC(=C)C(=O)OCC
Isomeric SMILES
CCOC(=C)C(=O)OCC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H12O3
Heavy Atom Count
10
Molecular Weight
144.17
Exact Molecular Weight
144.0786
Valence Electrons
58
Radical Electrons
0
tPSA
35.53
MolLogP
1.0997
H Bond Acceptors
3
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

 22 21  0  0  0  0  0  0  0  0999 V2000
    3.3834    0.4015    0.5064 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1543   -0.7582   -0.4496 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7802   -1.0783   -0.3785 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7687   -0.2128   -0.6821 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0567    0.9517   -1.0517 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6146   -0.6736   -0.5657 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9222   -1.8868   -0.1807 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6217    0.2341   -0.8828 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5507    0.5384    0.1607 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5290    1.5458   -0.4620 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3514    1.3278   -0.1054 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3863    0.2863    0.9579 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5999    0.4061    1.2894 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4609   -0.4742   -1.4603 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7040   -1.6441   -0.0469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9473   -2.1902   -0.1068 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1353   -2.5763    0.0607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0454    0.9675    1.0467 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0701   -0.4155    0.3826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1780    1.9714    0.3028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0850    0.9687   -1.2506 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9464    2.3108   -1.0374 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  2  3
  6  8  1  0
  8  9  1  0
  9 10  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  2 15  1  0
  7 16  1  0
  7 17  1  0
  9 18  1  0
  9 19  1  0
 10 20  1  0
 10 21  1  0
 10 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers