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
    3.9085    0.1128   -0.7499 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5134    0.1662   -0.5667 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9577   -0.6198    0.4222 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7071   -1.3442    1.1131 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5192   -0.6557    0.7143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3485    0.0735    0.0384 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7560   -0.0178    0.3879 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1826   -0.7663    1.3117 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7364    0.7192   -0.2768 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1002    0.6343    0.0577 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2349   -0.6779   -1.4471 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3102    1.0873   -1.1505 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4055   -0.0375    0.2297 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1374   -1.2896    1.5001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0662    0.7387   -0.7656 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4663   -0.4175    0.0741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6631    1.1528   -0.7617 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3745    1.1415    0.9838 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