Monomers

Methyl acrylate

Identifiers

IUPAC name
methyl prop-2-enoate
InchI
InChI=1S/C4H6O2/c1-3-4(5)6-2/h3H,1H2,2H3
InchI Key
BAPJBEWLBFYGME-UHFFFAOYSA-N
SMILES
COC(=O)C=C
Canonical SMILES
COC(=O)C=C
Isomeric SMILES
COC(=O)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H6O2
Heavy Atom Count
6
Molecular Weight
86.09
Exact Molecular Weight
86.0368
Valence Electrons
34
Radical Electrons
0
tPSA
26.3
MolLogP
0.3454
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

 12 11  0  0  0  0  0  0  0  0999 V2000
    2.1260    0.2361    0.1419 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7313    0.2415    0.2998 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1440   -0.3912   -0.5851 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3746   -0.9832   -1.5566 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5787   -0.3570   -0.3782 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1215    0.2663    0.6444 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4488    0.4181   -0.9075 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5170    1.0761    0.7814 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5436   -0.7418    0.4424 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2078   -0.8600   -1.0889 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5031    0.7844    1.3794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1862    0.3106    0.8271 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  2  3
  1  7  1  0
  1  8  1  0
  1  9  1  0
  5 10  1  0
  6 11  1  0
  6 12  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers