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
   -2.1691   -0.8550   -0.8244 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8605    0.1139    0.2721 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4674    0.6418    0.2032 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2901    1.9428    0.0666 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6992   -0.1989    0.2783 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6024   -1.4417    0.4080 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9701    0.3347    0.2099 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1117   -0.5023    0.2849 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4619   -0.8066   -1.6702 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1852   -0.6922   -1.2748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1606   -1.8748   -0.4142 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5928    0.9440    0.2029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0528   -0.3678    1.2679 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7042    2.3792    0.0113 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1634    2.5720    0.0104 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9924   -0.0591   -0.2286 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9368   -1.5033   -0.1452 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3868   -0.6266    1.3417 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