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
   -2.8084   -0.0003   -0.2726 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4654   -0.5806   -0.6149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3559    0.1272    0.0674 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5655    1.1451    0.8747 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9954   -0.3210   -0.1669 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2622   -1.2887   -0.9279 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0453    0.3184    0.4541 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3680   -0.1266    0.2196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8943    1.0745   -0.4661 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5626   -0.5398   -0.8922 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0939   -0.1900    0.7848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3152   -0.5226   -1.7020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4579   -1.6358   -0.2483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5765    1.4686    1.0403 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2284    1.6628    1.3721 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9841    0.7906    0.0697 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4366   -0.7381   -0.7035 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7757   -0.6435    1.1119 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