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
   -4.1302    1.0928    0.3817 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9449    0.8043   -0.3482 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7748    0.4570    0.2972 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8095    0.4082    1.5698 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5497    0.1577   -0.4327 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5443   -0.1694    0.2221 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7658   -0.4661   -0.5438 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7652   -0.4087   -1.7969 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9460   -0.8149    0.0774 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1367   -1.1041   -0.6708 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2726    2.1937    0.3184 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0055    0.5679   -0.0364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0010    0.8703    1.4685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5761    0.2141   -1.5107 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5409   -0.2176    1.2986 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9332   -1.2687    0.0879 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4011   -0.2533   -1.3288 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0312   -2.0631   -1.2227 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