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
    4.1647    0.5634   -1.0852 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7707    0.5410   -1.2520 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8548    0.3082   -0.2616 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2719    0.0950    0.8974 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4187    0.3014   -0.5152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4403    0.0734    0.4623 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8793    0.0599    0.2420 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3030    0.2702   -0.9037 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7548   -0.1818    1.2856 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1598   -0.2052    1.1218 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5948   -0.1680   -1.8207 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6148    1.5528   -1.3612 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4965    0.3525   -0.0562 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0041    0.4796   -1.4975 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0590   -0.1091    1.4593 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5292   -1.2572    1.0637 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4408    0.3517    0.2086 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6249    0.2512    2.0125 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