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
   -2.9374    1.0829   -0.0983 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7456    0.3208   -0.0402 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6973   -1.0535   -0.1374 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8796   -1.5749   -0.2898 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5380   -1.8999   -0.0886 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6880   -1.5557    0.0547 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2695   -0.2362    0.2084 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6637    0.8538    0.2308 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6742   -0.0889    0.3545 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2685    1.1795    0.5056 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1091    1.5613    0.8931 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8298    0.4399   -0.2749 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9252    1.8166   -0.9316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7527   -2.9822   -0.1895 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4172   -2.4178    0.0610 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8726    1.1643    1.4519 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0060    1.3871   -0.3109 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5550    2.0028    0.6002 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