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
   -3.5461    0.8396   -1.3897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7609    0.6905   -0.2150 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3686    0.6730   -0.2612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8359    0.7940   -1.3797 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5939    0.5201    0.9466 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1874    0.3962    2.0987 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8750    0.5056    0.8643 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3378   -0.5760    0.0357 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6878   -0.7350   -0.1486 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4788    0.0673    0.4106 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2891   -1.8095   -0.9786 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3783    1.5738   -1.2232 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0696   -0.1380   -1.5850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9492    1.0799   -2.2770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6783    0.2776    3.0491 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2652    0.4088    2.1433 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2885    1.4668    0.4729 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2752    0.2668    1.8702 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1997   -2.2064   -0.4485 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5964   -2.6604   -1.1437 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6049   -1.4345   -1.9750 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