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
   -2.0915   -0.1426   -0.0733 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7530    0.2512   -0.0592 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2348   -0.6432    0.3015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1063   -1.8031    0.6113 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6144   -0.1871    0.3011 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9567    1.0403   -0.0284 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7215    0.4684    0.6233 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2511   -1.2061    0.2033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4825    0.0154   -1.1187 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3775   -0.8949    0.5848 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2228    1.7932   -0.3226 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9998    1.3085   -0.0061 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