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
   -4.2590   -0.0358   -0.3800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9287    0.0986   -0.7952 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8532    0.1347    0.0935 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1062    0.0422    1.3017 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4802    0.2783   -0.4180 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5183    0.3104    0.4319 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8784    0.4515   -0.0561 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1403    0.5456   -1.2779 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9267    0.4844    0.8480 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2402    0.6218    0.3599 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8663    0.7084   -0.9653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4254    0.2131    0.6826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6949   -1.0283   -0.5961 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2716    0.3580   -1.4717 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3147    0.2310    1.4869 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8079   -0.3318    0.3686 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7778    1.3046    1.0505 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2813    1.0377   -0.6634 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