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
    4.0698    0.6526    0.0083 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6822    0.7346    0.3193 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7487   -0.0228   -0.3306 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1708   -0.8122   -1.2336 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3247    0.0183   -0.0570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5251   -0.7339   -0.7149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9573   -0.7137   -0.4621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7840   -1.4088   -1.0633 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4315    0.1487    0.5266 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7971    0.2091    0.8113 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4304    1.6626   -0.2891 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1677    0.0151   -0.8978 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6464    0.2427    0.8621 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0471    0.6839    0.7070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1709   -1.4031   -1.4799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9695    1.0038    1.5548 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2137   -0.7615    1.1455 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3444    0.4846   -0.1108 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