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
    3.9574    0.3387   -0.3355 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5655    0.5004   -0.1871 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7342   -0.6166   -0.2254 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2395   -1.7383   -0.3904 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2863   -0.5086   -0.0773 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3144    0.6511    0.1006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7534    0.6924    0.2409 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3911    1.7717    0.4139 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5131   -0.4726    0.1909 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9192   -0.4120    0.3301 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2724    0.0718   -1.3505 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4336    1.3034   -0.0555 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2954   -0.4350    0.3954 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2942   -1.4195   -0.1177 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2627    1.5533    0.1404 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2019    0.5041    0.8579 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3402   -0.4502   -0.7049 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3196   -1.3342    0.8306 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