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
   -2.7850    0.0914    0.4682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4201   -0.2487    0.9878 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3745    0.0466   -0.0184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7287    0.5393   -1.1745 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0444   -0.1980    0.2463 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4552   -0.6708    1.3379 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0100    0.0847   -0.7080 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3862   -0.1330   -0.5009 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5145   -0.2017    1.2641 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0569   -0.5027   -0.4217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9179    1.1620    0.2223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4346   -1.3187    1.2779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2398    0.3674    1.9047 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0071    0.7621   -1.9204 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7574    0.7275   -1.3934 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9298    0.8214   -0.2671 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5928   -0.8602    0.3006 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8039   -0.4687   -1.4792 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