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
   -2.5362    0.7119    0.2359 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0175    0.8511    0.2006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4180   -0.4999   -0.0793 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1591   -1.5621   -0.2505 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0273   -0.6414   -0.1644 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5473   -1.7750   -0.4000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7909    0.4970    0.0202 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1848    0.4088   -0.0528 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7976   -0.0163    1.0360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9151    0.3982   -0.7537 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9824    1.6973    0.4623 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6593    1.1970    1.1786 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7130    1.5674   -0.5771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7079   -2.5160   -0.4493 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2371   -1.5378   -0.2023 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4819    0.6237   -1.1087 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6155    1.1918    0.6266 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4956   -0.5958    0.2779 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