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
   -4.0185   -0.9593    0.1004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6065   -1.0013    0.1813 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7887    0.0618   -0.1759 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3840    1.1023   -0.5901 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3390   -0.0090   -0.0825 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4173    1.0029   -0.4236 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8631    0.9526   -0.3380 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5931    1.9192   -0.6634 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5397   -0.1903    0.1181 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9695   -0.2038    0.1893 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4479   -1.9216   -0.2553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3831   -0.1500   -0.5380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3840   -0.8391    1.1518 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1116   -0.9140    0.2747 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0479    1.9055   -0.7806 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2427   -0.2499    1.2611 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2855   -1.1729   -0.2656 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3772    0.6669   -0.3332 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