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
    3.7531   -0.0673    0.8858 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3725   -0.0374    0.5251 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9768   -0.1483   -0.8012 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8918   -0.2749   -1.6539 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5736   -0.1125   -1.1139 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3281    0.0224   -0.1697 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7450    0.0680   -0.3881 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1865   -0.0246   -1.5488 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6180    0.2120    0.6629 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0159    0.2612    0.4901 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7669    0.0282    1.9980 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1280   -1.0766    0.6324 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3233    0.7286    0.3770 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2585   -0.1972   -2.1327 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0551    0.1057    0.8673 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4724   -0.7673    0.5239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2358    0.7769   -0.4683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4979    0.8341    1.3139 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