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
   -3.8982    0.6034    0.1804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5241    0.4405   -0.0288 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6378   -0.1202    0.8500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0811   -0.5325    1.9517 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2126   -0.2707    0.5920 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2805    0.1526   -0.5547 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6884    0.0271   -0.8613 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1043    0.4465   -1.9671 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5131   -0.5528    0.0857 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9004   -0.6943   -0.1767 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4104    0.3607   -0.7925 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3092   -0.0328    0.9876 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1866    1.6518    0.4359 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4442   -0.7275    1.3349 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3788    0.6001   -1.2761 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4001   -1.1345    0.7202 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9825   -1.3667   -1.0551 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3254    0.3020   -0.4260 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