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
    3.1145   -0.3145   -0.5044 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8068   -0.6199   -0.0554 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7920    0.3265   -0.0133 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0728    1.4900   -0.3940 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5435    0.0049    0.4477 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8973   -1.1998    0.8598 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5129    0.9933    0.4660 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7718    0.8843   -0.1352 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4865   -1.1849   -1.0751 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7170   -0.1176    0.4175 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1283    0.5512   -1.1744 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8888   -1.4363    1.2016 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1047   -1.9640    0.8335 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3659    0.0317    0.2825 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3224    1.8315    0.0820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7107    0.7235   -1.2387 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