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
   -2.2606   -0.3139    0.2536 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9869   -0.8296   -0.0717 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0617    0.0777   -0.1931 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1312    1.3207   -0.0159 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3833   -0.3969   -0.5239 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4003    0.4468   -0.6457 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1871    0.1327    1.2526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0015   -1.1436    0.2031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5148    0.5160   -0.4480 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5766   -1.4458   -0.6799 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2701    1.5166   -0.5007 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3900    0.1192   -0.8904 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