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
   -2.5162    0.3933    0.9090 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0845    0.7134    0.5290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3931   -0.4689   -0.0029 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0524   -1.5914   -0.0820 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9775   -0.4053   -0.4302 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5240   -1.4446   -0.8781 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7611    0.7386   -0.3857 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0981    0.6907   -0.8312 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4791   -0.3818    1.7056 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0668    0.0558    0.0181 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9461    1.3286    1.3219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5952    1.1164    1.4412 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0704    1.5504   -0.2136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5809   -2.5011   -0.4717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0895   -1.7234    0.2194 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2746   -0.1716   -1.5235 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4312    1.5898   -1.3504 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8078    0.5111    0.0252 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