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
    3.8447    0.7722   -0.5658 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9567   -0.2904   -0.3247 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5485   -0.1018   -0.2993 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2113    1.0705   -0.5081 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7232   -1.2502   -0.0445 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5680   -1.3294    0.0268 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5674   -0.3032   -0.1253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2532    0.8668   -0.3620 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9420   -0.5656   -0.0155 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9058    0.4562   -0.1683 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3224    1.6378   -1.0589 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3453    1.1126    0.3754 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5863    0.4134   -1.3154 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2591   -2.2276    0.1184 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9964   -2.3548    0.2408 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2887    0.4602   -1.2271 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4954    1.4516    0.0864 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7807    0.1817    0.4569 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