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
    2.3020   -0.2721   -0.3069 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9884   -0.7846   -0.4220 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1062    0.0478   -0.2143 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1393    1.2563    0.0755 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4740   -0.4230   -0.3191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4418    0.4267   -0.1080 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8797   -0.3370   -1.2410 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3051    0.8041    0.0087 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8212   -0.8971    0.4587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7198   -1.4445   -0.5638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4913    0.1796   -0.1608 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2027    1.4438    0.1358 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