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
   -2.3469   -0.3903    0.6777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7846    0.5523   -0.3667 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3889    0.2052   -0.7257 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1067   -0.1037   -1.9603 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6857    0.1984    0.2657 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4132    0.4969    1.4588 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9879   -0.1209   -0.0470 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0574   -0.1459    0.8508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4497   -0.3147    0.6281 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9810   -0.0607    1.6564 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0356   -1.4419    0.5038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7738    1.5621    0.1050 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3992    0.6223   -1.2591 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8799   -0.1042   -2.7000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8935   -0.3581   -2.2455 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2839    0.8139    1.3249 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9638   -0.4508    0.2778 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8610   -0.9599    1.5897 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