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
    3.5295    1.2271   -0.5284 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7288    0.3961    0.3103 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4613   -0.0479   -0.1135 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1199    0.3472   -1.2624 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6366   -0.8894    0.7213 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0529   -1.2625    1.9041 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6807   -1.3273    0.2332 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4394   -0.1327   -0.0053 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7262   -0.1389   -0.4696 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2628   -1.2631   -0.6963 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4926    1.1202   -0.7090 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1878    1.8845    0.0774 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1879    0.5827   -1.1472 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9021    1.9139   -1.1419 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4490   -1.8979    2.5540 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0223   -0.9591    2.3012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5419   -1.8990   -0.7051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1624   -1.9618    0.9732 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1146    1.8939   -0.0223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2848    1.4139   -1.7605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5727    1.0002   -0.5131 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