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
   -3.7842    0.4921   -0.4470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9143   -0.6143   -0.3982 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5358   -0.3419   -0.2051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2727    0.8677   -0.1021 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5649   -1.3976   -0.1405 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7067   -1.3317    0.0271 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5276   -0.1665    0.1994 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1460    1.0229    0.2183 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9272   -0.2995    0.3720 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7755    0.8187    0.5452 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8161    0.0968   -0.2732 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5828    1.2191    0.3761 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7516    0.9940   -1.4419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0229   -2.4189   -0.2578 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2389   -2.3242    0.0389 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7189    0.4829    0.9716 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3212    1.5272    1.2982 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8834    1.3732   -0.4149 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