Monomers

Methyl 2-ethylacrylate

Identifiers

IUPAC name
methyl 2-methylidenebutanoate
InchI
InChI=1S/C6H10O2/c1-4-5(2)6(7)8-3/h2,4H2,1,3H3
InchI Key
JKJJSJJGBZXUQV-UHFFFAOYSA-N
SMILES
CCC(=C)C(=O)OC
Canonical SMILES
CCC(=C)C(=O)OC
Isomeric SMILES
CCC(=C)C(=O)OC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H10O2
Heavy Atom Count
8
Molecular Weight
114.144
Exact Molecular Weight
114.0681
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.1256
H Bond Acceptors
2
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

 18 17  0  0  0  0  0  0  0  0999 V2000
   -2.1190   -1.1925   -0.2027 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6315    0.0699   -0.8877 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4768    0.6684   -0.1935 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5413    1.8776    0.2857 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7204   -0.1164   -0.0595 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8678   -1.2834   -0.4892 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7985    0.4781    0.6036 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0191   -0.2192    0.7830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0627   -1.4866   -0.7258 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3623   -1.9964   -0.4144 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2828   -1.0344    0.8725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3100   -0.1997   -1.9233 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4667    0.8011   -1.0297 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2712    2.3711    0.8044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4717    2.4572    0.1689 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6345   -0.0077   -0.1137 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5810    0.1393    1.6597 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8323   -1.3263    0.8620 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  3
  3  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  4 14  1  0
  4 15  1  0
  8 16  1  0
  8 17  1  0
  8 18  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers