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
   -2.3272    0.1534    0.0193 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1246   -0.1478    0.7056 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1219    0.0167    0.0880 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0797    0.4435   -1.0963 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3666   -0.2858    0.7728 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5160   -0.1183    0.1593 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1080   -0.5192    0.4639 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6370    1.2102    0.1529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2574   -0.0185   -1.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3892   -0.6504    1.7864 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5140    0.2458   -0.8555 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4668   -0.3296    0.6274 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