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
   -2.6389   -0.3024   -0.4668 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1544   -0.6041   -0.5439 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3586    0.4762    0.0777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9414    1.5262    0.6050 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0835    0.3710    0.1031 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7377    1.3011    0.6365 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7379   -0.7435   -0.4546 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1657   -0.7476   -0.3760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9485   -0.2117    0.5934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1864   -1.1105   -0.9886 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8112    0.6669   -1.0078 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9227   -1.5723   -0.0724 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9222   -0.7161   -1.6351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0191    1.6369    0.6031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3674    2.3212    1.0617 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4729   -0.3777    0.6360 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6123   -0.0971   -1.1433 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4608   -1.8166   -0.5062 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