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
   -2.0848    1.0235    0.6891 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6938    0.3631   -0.6341 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5114   -0.5004   -0.4280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5656   -1.7869   -0.6761 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7272    0.0720    0.0537 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7551    1.3036    0.2838 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8776   -0.6641    0.2729 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0846   -0.0526    0.7520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1351    2.1255    0.5318 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3040    0.8233    1.4292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0936    0.6931    1.0217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4977    1.1439   -1.4210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5755   -0.1951   -0.9901 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4858   -2.2086   -1.0333 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2781   -2.4307   -0.5340 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2559    0.9248    0.2760 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9271   -0.7543    0.5823 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0417    0.1200    1.8474 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