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
   -2.6785    0.9322    0.0219 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2112    1.1146    0.2911 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4066   -0.0523   -0.1299 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9658   -1.1100   -0.6760 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0311   -0.0100    0.0727 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5871    0.9911    0.5930 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8751   -1.0531   -0.2877 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2746   -0.9844   -0.0781 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1625    1.9313    0.2206 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8741    0.7245   -1.0471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1164    0.1814    0.6985 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8874    2.0089   -0.3034 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0600    1.2826    1.3722 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3830   -1.9637   -0.9848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0255   -1.1478   -0.8283 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5705   -0.0157    0.3964 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7864   -1.0550   -1.0543 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6462   -1.7746    0.6005 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