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
    4.2778   -0.0285   -0.2800 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0254    0.4140    0.1654 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8696   -0.1723   -0.3194 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0112   -1.0978   -1.1582 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5515    0.2621    0.1212 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5654   -0.2841   -0.3289 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8696    0.1740    0.1324 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9190    1.1005    0.9687 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0376   -0.3805   -0.3232 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3275    0.0255    0.0907 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7882   -0.6926    0.4631 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8987    0.8886   -0.4558 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2265   -0.5306   -1.2790 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4994    1.0625    0.8440 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4790   -1.0939   -1.0615 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5888   -0.6335    0.9649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3237    1.0637    0.5079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0378   -0.0769   -0.7379 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