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
   -2.6090    0.5774   -0.2040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1303    0.6675   -0.2773 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4136   -0.5478    0.1354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0079   -1.6480    0.5435 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0417   -0.5278    0.0877 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7051   -1.5313    0.4264 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7631    0.5798   -0.3267 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1794    0.6004   -0.3735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0127    1.6324   -0.2351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9741    0.0390   -1.1164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0058    0.1227    0.7180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8535    0.8513   -1.3544 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7083    1.5206    0.2799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4890   -2.5390    0.8463 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0999   -1.7007    0.5927 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5407    0.2260    0.5961 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5815   -0.0009   -1.2011 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4927    1.6785   -0.4286 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