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
    3.9025    0.5664    0.3762 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4949    0.6048    0.2658 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7883   -0.5826    0.1500 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4441   -1.6513    0.1489 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3377   -0.5560    0.0355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3361    0.5782    0.0384 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7992    0.6104   -0.0768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4363    1.6928   -0.0735 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4976   -0.5653   -0.1913 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9276   -0.6027   -0.3073 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4025    1.2489   -0.3638 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3280   -0.4340    0.2374 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1653    0.9902    1.3871 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1979   -1.4936   -0.0541 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2184    1.5014    0.1289 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1677   -1.5874   -0.7590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3036    0.1995   -0.9611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4159   -0.5200    0.6782 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