Monomers

Methyl 2-(acetoxymethyl)acrylate

Identifiers

IUPAC name
methyl 2-(acetyloxymethyl)prop-2-enoate
InchI
InChI=1S/C7H10O4/c1-5(7(9)10-3)4-11-6(2)8/h1,4H2,2-3H3
InchI Key
IMOQCGSCOCUDGV-UHFFFAOYSA-N
SMILES
COC(=O)C(=C)COC(=O)C
Canonical SMILES
CC(=O)OCC(=C)C(=O)OC
Isomeric SMILES
CC(=O)OCC(=C)C(=O)OC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H10O4
Heavy Atom Count
11
Molecular Weight
158.153
Exact Molecular Weight
158.0579
Valence Electrons
62
Radical Electrons
0
tPSA
52.6
MolLogP
0.2787
H Bond Acceptors
4
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

 21 20  0  0  0  0  0  0  0  0999 V2000
    4.3222    0.3876    0.2809 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9753    0.3460    0.6832 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9492    0.1181   -0.2199 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2727   -0.0505   -1.4187 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5859    0.0876    0.2592 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3368    0.2748    1.5361 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5092   -0.1569   -0.7133 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7677   -0.1451   -0.0241 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9361   -0.3480   -0.7037 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8632   -0.5462   -1.9619 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2719   -0.3450   -0.0312 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9748    0.2696    1.1905 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5956    1.3426   -0.2057 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5815   -0.4519   -0.4152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6845    0.2585    1.9354 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1813    0.4490    2.1973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3784   -1.1196   -1.2540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5153    0.6262   -1.5238 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4909    0.6500    0.4121 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0539   -0.5283   -0.7857 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3042   -1.1185    0.7623 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
  5  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  6 15  1  0
  6 16  1  0
  7 17  1  0
  7 18  1  0
 11 19  1  0
 11 20  1  0
 11 21  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers