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
   -2.0762   -0.2636   -0.4631 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7193   -0.3765   -0.1467 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1463    0.6969    0.0077 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3560    1.8422   -0.1552 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5522    0.5279    0.3376 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0814   -0.6523    0.5081 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4485   -1.3145   -0.6449 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7025    0.1169    0.3703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2594    0.2756   -1.4161 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1631    1.4014    0.4418 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4953   -1.5322    0.4100 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1237   -0.7217    0.7504 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