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
    2.9826   -1.4367   -0.0237 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9333   -0.1058    0.6993 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5602    0.3126    0.6379 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9171    0.5194   -0.5693 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6025    0.3204   -1.6034 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4698    0.9426   -0.6824 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9777    1.1083   -1.8905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2916    1.1827    0.3958 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6394    0.8337    0.3207 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8792   -0.6334    0.0834 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2379   -1.3309   -1.0959 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6957   -2.0720    0.5359 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9988   -1.9439    0.0268 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2904   -0.1668    1.7245 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5906    0.6023    0.1568 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9947    1.4195   -2.0761 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3804    0.9349   -2.7996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1051    1.0807    1.3013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2133    1.4250   -0.4402 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8752   -1.1518    1.0688 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8593   -0.7400   -0.4264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1233   -1.1008   -0.5719 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