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
   -3.8929   -0.0011    0.9382 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4879    0.1692    0.7777 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7586   -0.6891   -0.0668 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4316   -1.5794   -0.6400 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3255   -0.5331   -0.2448 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3009    0.4261    0.3938 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7472    0.6387    0.2584 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2890    1.5731    0.8950 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5450   -0.1483   -0.5433 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9436    0.0512   -0.6791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2263   -1.0079    0.6261 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1557    0.1630    2.0054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3787    0.7428    0.2922 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1625   -1.2309   -0.9091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2511    1.0807    1.0370 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1250    0.3589   -1.7307 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5034   -0.8634   -0.4499 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2915    0.8494    0.0227 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