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
    2.0790    0.4164    0.4588 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6496    0.4361    0.3722 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0418   -0.6571   -0.1237 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6276   -1.6530   -0.4893 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4919   -0.5993   -0.1960 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1688    0.4654    0.1975 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4335    0.1391   -0.5485 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4004   -0.3752    1.1636 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4242    1.4233    0.7673 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0405   -1.4485   -0.5819 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6246    1.3343    0.5912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2467    0.5184    0.1478 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