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
    1.5977    0.8742    0.9147 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5565   -0.4111    0.1539 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5188   -0.4076   -0.9066 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8954   -0.5765   -2.1487 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8929   -0.2243   -0.6144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7357   -0.2276   -1.5350 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2576   -0.0484    0.7091 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6036    0.1391    1.1100 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6061    0.9651    1.3791 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8389    0.8575    1.7204 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4299    1.7268    0.2550 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2376   -1.2179    0.8779 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5061   -0.7102   -0.2815 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9276   -0.7133   -2.3888 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1768   -0.5800   -2.9405 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2983   -0.0194    0.2672 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8144   -0.5902    1.9113 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6891    1.1636    1.5168 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