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
   -2.9227    1.0105   -0.5553 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7358    0.3028   -0.3061 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6663   -1.0353   -0.0126 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8455   -1.5924    0.0109 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5028   -1.8484    0.2574 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7294   -1.5355    0.2908 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3278   -0.2600    0.0653 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6323    0.7425   -0.2071 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7236   -0.0751    0.1396 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2095    1.2283   -0.1010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9026    1.5637   -1.5131 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0247    1.7705    0.2640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8228    0.3667   -0.5455 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7068   -2.9505    0.4777 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4513   -2.3583    0.5267 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4745    1.7521    0.8386 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4733    1.8142   -0.6823 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1083    1.1043   -0.7608 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