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
   -3.8081    0.9538    0.1871 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4267    0.6520    0.1069 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0084   -0.6598   -0.1143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9166   -1.5218   -0.2327 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6005   -1.0109   -0.2031 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3483   -0.1098   -0.0793 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7675   -0.4259   -0.1626 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1744   -1.5976   -0.3610 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7154    0.5769   -0.0224 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0917    0.3326   -0.0932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4473    0.0512    0.0475 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9552    1.4064    1.2095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1160    1.6961   -0.5763 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3219   -2.0352   -0.3748 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0479    0.9184    0.0936 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2452   -0.6114   -0.6631 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6458    1.1918   -0.5695 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5645    0.1933    0.9172 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