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
    4.0953   -0.4071    0.2691 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7227   -0.6860    0.0291 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7219    0.2429    0.2478 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0744    1.3704    0.6765 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3133   -0.0325    0.0053 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5869    0.8869    0.2311 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0103    0.6947    0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8071    1.6237    0.2559 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4280   -0.5348   -0.4549 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8184   -0.7272   -0.6667 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5153    0.3129   -0.4580 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2477    0.0258    1.2921 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6362   -1.3752    0.2625 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0395   -0.9886   -0.3638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2518    1.8465    0.5996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9454   -1.7220   -1.1151 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1348    0.1042   -1.3488 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3044   -0.6346    0.3339 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