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

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
    3.9044   -0.3920    0.1320 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5260   -0.1864   -0.1105 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6478   -0.3868    0.9511 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0911   -0.7350    2.0646 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2270   -0.1766    0.7077 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2326    0.1914   -0.4718 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6476    0.3974   -0.7024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0961    0.7460   -1.8149 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5313    0.2063    0.3272 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9068    0.3843    0.1849 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1115   -0.1868    1.2056 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5475    0.3128   -0.4469 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2291   -1.4228   -0.0725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4394   -0.3369    1.5435 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4489    0.3456   -1.2911 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2026    1.1893   -0.5004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3133    0.6519    1.2032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3636   -0.6020   -0.0606 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