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
   -3.8330    0.4662    0.1104 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9282   -0.6026    0.2581 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5412   -0.3226    0.1273 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2535    0.8646   -0.1099 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5654   -1.3698    0.2670 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7069   -1.2730    0.1769 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5291   -0.1340   -0.0817 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1646    1.0472   -0.2809 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9423   -0.3203   -0.1271 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7768    0.7945   -0.3818 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4544    1.1281   -0.7067 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9906    1.0239    1.0599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8391    0.1060   -0.2234 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9855   -2.3832    0.4794 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2661   -2.2311    0.3235 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9487    1.4188    0.5113 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7625    0.4301   -0.7375 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2940    1.3572   -1.2140 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