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
    3.8515   -0.9003    0.1484 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4488   -0.7140    0.1517 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9098    0.2035   -0.7280 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6765    0.8316   -1.4898 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4658    0.4024   -0.7320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3390   -0.2585    0.0695 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7656   -0.0077    0.0091 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2430    0.8477   -0.8146 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6509   -0.6834    0.8373 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0266   -0.3795    0.7144 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1343   -1.8877   -0.3148 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3827   -0.0541   -0.3644 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1953   -0.9654    1.2049 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0374    1.1185   -1.4174 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0275   -0.9792    0.7685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5704   -0.5790    1.6605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1187    0.6833    0.4089 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4154   -1.0426   -0.1120 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