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
   -3.5132    1.3541    0.6619 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8227    0.2202    0.1203 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4505    0.1046    0.2806 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8559    1.0167    0.9066 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7155   -1.0534   -0.2676 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3419   -2.0006   -0.9192 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7592   -1.1505   -0.0797 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3952   -0.0389   -0.6712 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7669    0.0555   -0.6042 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3995   -0.8519   -0.0189 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5118    1.1804   -1.1936 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7779    2.0829   -0.1294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4833    0.9387    1.0445 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9858    1.7911    1.5190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8034   -2.8329   -1.3115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4005   -1.9402   -1.0595 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9790   -1.2281    1.0117 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1354   -2.0465   -0.6120 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5269    0.8249   -1.4665 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6267    2.0355   -0.4881 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0500    1.5383   -2.1501 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