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
   -2.0088    0.7769    0.3713 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5948    0.6102    0.1909 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0517   -0.6624    0.1072 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8307   -1.6420    0.1939 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3898   -0.8573   -0.0770 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2390    0.1305   -0.1724 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2817    0.1537    1.2625 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2285    1.8404    0.5894 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5589    0.4487   -0.5257 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7484   -1.8711   -0.1345 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2764   -0.0704   -0.3057 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9017    1.1425   -0.1178 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