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
    3.8915   -1.1660   -0.3699 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5025   -0.8581   -0.2569 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0602    0.4578   -0.2614 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9691    1.3378   -0.3712 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6561    0.8166   -0.1487 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2589    2.0756   -0.1553 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3778   -0.2364   -0.0220 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6725    0.2770    0.0759 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7363   -0.5911    0.1991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4961   -1.8200    0.2186 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1508   -0.1235    0.3091 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0819   -2.1577    0.0902 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2134   -1.2382   -1.4210 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4416   -0.3494    0.1780 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9618    2.9073   -0.2453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7798    2.3625   -0.0727 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3066   -0.8545   -0.9560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0963   -0.8940    0.8235 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1342    0.8668    0.8403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6900   -0.8766    0.9077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5966    0.0640   -0.6797 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