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
    4.0554   -0.4949   -0.3554 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6908   -0.6775   -0.0883 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7414    0.2316   -0.4838 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0813    1.2850   -1.1160 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3218    0.0531   -0.2124 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5879    0.9293   -0.5942 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9944    0.7336   -0.3146 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8935    1.5387   -0.6578 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3744   -0.4091    0.3725 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7185   -0.6479    0.6688 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6548   -0.4838    0.5704 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1735    0.4518   -0.9506 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4334   -1.3026   -1.0461 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0329   -0.8401    0.3237 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2818    1.8154   -1.1284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3946   -0.2557   -0.1266 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0331   -0.1655    1.6056 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9071   -1.7616    0.7024 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