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
    3.3568    0.9276    0.3004 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6629   -0.2517   -0.0368 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2405   -0.3061   -0.0709 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7083    0.7844    0.2252 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5721   -1.5273   -0.4195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6910   -1.7641   -0.5022 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8229   -0.9120   -0.2804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9970   -1.3953   -0.4305 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7291    0.3935    0.0838 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8511    1.2438    0.3052 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1683    1.1437   -0.4535 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6909    1.8092    0.3913 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9105    0.7200    1.2583 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2368   -2.3937   -0.6515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9916   -2.8190   -0.7996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9759    1.4689    1.3767 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7173    2.1839   -0.2346 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7712    0.6943   -0.0105 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