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
   -1.5557    1.3568   -0.0536 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5427   -0.0870   -0.5112 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5730   -0.9140    0.2455 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9456   -1.9587    0.9494 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8235   -0.5413    0.1936 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6357   -1.2488    0.8382 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3056    0.5341   -0.5157 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6974    0.7847   -0.4793 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5624    1.7549    0.1757 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0258    1.9367   -0.8966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2116    1.3800    0.8560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5837   -0.4875   -0.3514 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3814   -0.1612   -1.6141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9979   -2.2512    0.9968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2694   -2.5819    1.5111 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9502    0.9546    0.6045 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9742    1.6491   -1.1073 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2624   -0.1193   -0.8414 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