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
    1.7900    0.7320   -3.7587 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7851    0.2843   -2.8508 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9397    0.3898   -1.4766 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0186    0.9038   -1.0716 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0886   -0.0683   -0.5509 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0596    0.0326    0.7567 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9415   -0.4123    1.7036 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0408   -0.9352    1.3270 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7788   -0.3030    3.0775 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7363   -0.7280    4.0073 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6059    0.2532   -4.7306 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7890    0.4734   -3.3784 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7122    1.8495   -3.8129 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9870   -0.4987   -0.9853 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9723    0.4681    1.1262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6263   -0.1748    4.9717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7636   -0.4466    3.6405 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7095   -1.8198    4.2031 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