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
   -2.7589    0.4622   -0.6055 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3126    0.8675   -0.7523 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3921   -0.1114   -0.1500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7987   -1.2176    0.4494 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0352    0.1567   -0.2207 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4191    1.2033   -0.7878 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9714   -0.7387    0.3355 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3220   -0.3883    0.2143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9794   -0.5101   -1.0805 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9952    0.3485    0.4701 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3601    1.2742   -1.0918 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0827    0.9848   -1.8456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2105    1.8791   -0.3008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8488   -1.4735    0.5344 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0863   -1.9065    0.8769 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6209    0.1765    1.1075 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5183    0.2843   -0.6588 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9385   -1.2911    0.0355 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