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
    3.5199   -0.7210    0.0911 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207   -1.1486    1.0529 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1477   -0.7549    0.5565 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8919    0.5984    0.3377 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8015    1.4261    0.5887 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3950    1.0400   -0.1683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6089    2.3187   -0.3650 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4102    0.1432   -0.4510 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5400    0.0404    0.4287 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4809   -0.9910   -0.1006 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0050   -1.6010   -0.3552 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2306   -0.0816    0.6642 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1180   -0.1049   -0.7391 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4506   -2.2490    1.1536 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5611   -0.7201    2.0653 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1832    3.0169   -0.1442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5542    2.6745   -0.7397 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1977   -0.1689    1.4534 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0053    1.0581    0.4605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5985   -1.7901    0.6885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4555   -0.5463   -0.3421 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0840   -1.4388   -1.0301 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