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
   -2.1959    1.0128    0.6188 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7007   -0.4138    0.8848 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4636   -0.7111    0.1459 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4278   -1.6887   -0.7229 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7128    0.1000    0.3997 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7058    1.0470    1.2307 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8819   -0.1491   -0.2707 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0822    0.5472   -0.1266 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2736    1.0605    0.9284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5963    1.7286    1.1884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2084    1.2182   -0.4796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4793   -0.4897    1.9716 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5270   -1.0932    0.6103 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2937   -2.3007   -0.9229 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4808   -1.9048   -1.2637 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9971    1.5274    0.3581 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5425    0.6135   -1.1545 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7632   -0.1040    0.4923 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