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
   -1.8370   -0.9301    0.2569 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3574    0.0868    1.2745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3544    1.0067    0.7235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5783    2.2960    0.6969 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8954    0.4853    0.2039 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7778    1.2682   -0.2781 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2132   -0.8608    0.1933 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4668   -1.3090   -0.3354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4115   -0.4414   -0.5630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5637   -1.5841    0.8030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0361   -1.5862   -0.1067 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8744   -0.4943    2.0891 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2624    0.6025    1.6508 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1422    3.0158    0.2952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5104    2.6728    1.0856 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4192   -2.3836   -0.6047 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6290   -0.7699   -1.3102 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2419   -1.0745    0.3996 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