Monomers

Dipropyl maleate

Identifiers

IUPAC name
dipropyl (Z)-but-2-enedioate
InchI
InChI=1S/C10H16O4/c1-3-7-13-9(11)5-6-10(12)14-8-4-2/h5-6H,3-4,7-8H2,1-2H3/b6-5-
InchI Key
DSTWFRCNXMNXTR-WAYWQWQTSA-N
SMILES
CCCOC(=O)/C=C\C(=O)OCCC
Canonical SMILES
CCCOC(=O)C=CC(=O)OCCC
Isomeric SMILES
CCCOC(=O)/C=C\C(=O)OCCC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H16O4
Heavy Atom Count
14
Molecular Weight
200.234
Exact Molecular Weight
200.1049
Valence Electrons
80
Radical Electrons
0
tPSA
52.6
MolLogP
1.449
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

 30 29  0  0  0  0  0  0  0  0999 V2000
    6.1680   -0.4985   -0.2441 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6688   -0.3827   -0.4605 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2134    0.8770    0.2859 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8342    1.0903    0.1576 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8530    0.2139    0.5714 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1998   -0.8636    1.1067 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4455    0.5544    0.3802 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4857   -0.2810    0.7747 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9020    0.0744    0.5760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1973    1.1676    0.0339 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9232   -0.7648    0.9710 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2645   -0.4138    0.7717 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6482   -0.2308   -0.6606 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1136    0.1425   -0.8118 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5304   -1.5308   -0.3592 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3770   -0.0950    0.7693 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6360    0.1967   -0.9809 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4773   -0.2983   -1.5285 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2069   -1.2838   -0.0605 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5871    0.8862    1.3091 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7144    1.7444   -0.2358 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1473    1.4801   -0.0797 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2561   -1.2188    1.2394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4794    0.5013    1.3772 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8773   -1.2150    1.2737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0855    0.5964   -1.1272 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4053   -1.1428   -1.2277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4743    0.7657    0.0108 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2685    0.7296   -1.7627 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6781   -0.8007   -0.9254 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  2  3
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
  1 15  1  0
  1 16  1  0
  1 17  1  0
  2 18  1  0
  2 19  1  0
  3 20  1  0
  3 21  1  0
  7 22  1  0
  8 23  1  0
 12 24  1  0
 12 25  1  0
 13 26  1  0
 13 27  1  0
 14 28  1  0
 14 29  1  0
 14 30  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers