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
    3.9563    0.1156   -0.0579 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5379    0.2590    0.0491 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6776   -0.7655   -0.3171 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1358   -1.8427   -0.7515 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2292   -0.5560   -0.1833 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2506    0.5815    0.2754 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6725    0.7935    0.4091 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1281    1.8724    0.8442 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5360   -0.2275    0.0442 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9197   -0.0671    0.1565 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2898    0.0865   -1.1127 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4428    0.9196    0.5304 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1957   -0.8882    0.3840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4347   -1.3724   -0.4761 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4123    1.3771    0.5601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2227    0.8379    0.6797 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4108   -0.1676   -0.8490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3024   -0.9560    0.7360 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