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
    2.3025   -0.1968   -0.5196 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1152   -0.5028    0.1682 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1165    0.0560   -0.1054 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1400    0.9063   -1.0567 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3318   -0.2691    0.6120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4704    0.3094    0.2892 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1597   -0.4299   -1.6123 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0975   -0.8687   -0.1684 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5970    0.8522   -0.4622 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3199   -0.9873    1.4177 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4038    0.1023    0.7923 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4895    1.0284   -0.5153 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