Monomers

Methyl 2-methoxyacrylate

Identifiers

IUPAC name
methyl 2-methoxyprop-2-enoate
InchI
InChI=1S/C5H8O3/c1-4(7-2)5(6)8-3/h1H2,2-3H3
InchI Key
BTTXESIFAHCXMK-UHFFFAOYSA-N
SMILES
COC(=O)C(=C)OC
Canonical SMILES
COC(=C)C(=O)OC
Isomeric SMILES
COC(=C)C(=O)OC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H8O3
Heavy Atom Count
8
Molecular Weight
116.116
Exact Molecular Weight
116.0473
Valence Electrons
46
Radical Electrons
0
tPSA
35.53
MolLogP
0.3195
H Bond Acceptors
3
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

 16 15  0  0  0  0  0  0  0  0999 V2000
    2.2038   -0.1365   -1.8755 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7046    0.0855   -0.5503 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3316   -0.0518   -0.3738 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4213   -0.3601   -1.3581 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2714    0.1526    0.9311 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4997    0.4684    1.9389 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6187    0.0131    1.0825 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5638   -0.1834    0.0816 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0468   -1.1950   -2.1913 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6934    0.5720   -2.5312 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2994    0.0124   -1.8252 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0693    0.6251    2.9206 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5728    0.5916    1.8747 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5207    0.6950   -0.6236 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5768   -0.1606    0.5815 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4486   -1.1283   -0.4858 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
  1  9  1  0
  1 10  1  0
  1 11  1  0
  6 12  1  0
  6 13  1  0
  8 14  1  0
  8 15  1  0
  8 16  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers