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
   -1.6049   -1.1900    0.1718 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4910    0.0778   -0.6609 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5259    1.0153   -0.0342 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8992    2.1998    0.3440 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8468    0.5969    0.1546 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6530    1.3905    0.6825 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2956   -0.6656   -0.2352 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6375   -1.0810   -0.0532 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8450   -2.0310   -0.5258 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4904   -1.0432    0.8303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6976   -1.3797    0.7554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4875    0.5653   -0.7510 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1852   -0.2061   -1.6873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9126    2.5058    0.2035 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1962    2.8640    0.7930 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2204   -0.9601   -0.9941 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5829   -2.1643    0.2291 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0993   -0.4944    0.7774 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