Monomers

Dimethyl maleate

Identifiers

IUPAC name
dimethyl (Z)-but-2-enedioate
InchI
InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3-
InchI Key
LDCRTTXIJACKKU-ARJAWSKDSA-N
SMILES
COC(=O)/C=C\C(=O)OC
Canonical SMILES
COC(=O)C=CC(=O)OC
Isomeric SMILES
COC(=O)/C=C\C(=O)OC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H8O4
Heavy Atom Count
10
Molecular Weight
144.126
Exact Molecular Weight
144.0423
Valence Electrons
56
Radical Electrons
0
tPSA
52.6
MolLogP
-0.1114
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

 18 17  0  0  0  0  0  0  0  0999 V2000
   -3.9935    0.3397   -0.4404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6179    0.0108   -0.2282 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5953    0.8950   -0.4940 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8979    2.0298   -0.9393 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1803    0.5551   -0.2751 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1929   -0.6166    0.1887 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5860   -0.9530    0.4048 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9844   -2.0471    0.8411 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5889   -0.0075    0.1148 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9579   -0.3038    0.3143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6052   -0.5046   -0.0644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2597    1.3104    0.0282 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1192    0.3632   -1.5472 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5927    1.2775   -0.4963 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5641   -1.3443    0.4129 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3321    0.2686    1.2002 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0839   -1.3885    0.4286 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5144    0.1151   -0.5610 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
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  5 14  1  0
  6 15  1  0
 10 16  1  0
 10 17  1  0
 10 18  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers