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
    4.0610    0.5394    0.4330 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6910    0.8246    0.2365 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7886   -0.2071    0.4040 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2206   -1.3399    0.7199 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3584   -0.0212    0.2260 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5037   -1.0053    0.3857 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9305   -0.8038    0.2043 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7737   -1.7257    0.3505 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4634    0.4428   -0.1487 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8573    0.6284   -0.3232 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2894   -0.5246    0.2157 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6288    1.1586   -0.3146 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3075    0.8342    1.4740 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0099    0.9867   -0.0517 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1455   -1.9819    0.6567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1350    0.4639   -1.3936 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4513    0.0154    0.3714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0949    1.7154   -0.1398 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