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
   -2.7369    0.5317   -0.0979 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3803    0.9434    0.3809 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3620   -0.0088   -0.1130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7465   -1.0221   -0.8547 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0618    0.1569    0.2086 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3910    1.1355    0.9187 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9558   -0.7714   -0.2876 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3251   -0.5937    0.0341 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0196   -0.4528    0.2903 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4842    1.3164    0.2374 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8306    0.5293   -1.2015 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1106    1.9764    0.0708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3844    0.9158    1.5077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7775   -1.1831   -1.1153 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0156   -1.7048   -1.2041 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9324   -0.7450   -0.8888 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6325   -1.3884    0.7535 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5183    0.3648    0.5213 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