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
    4.6839   -0.2837   -1.1144 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8228    0.1364    0.3365 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9534    1.3329    0.6334 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6194    1.0135    0.3812 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9501    0.0134    1.0407 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5339   -0.6593    1.9140 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5666   -0.2677    0.7294 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0306    0.4566   -0.1977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4343    0.2346   -0.5728 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0071    0.9165   -1.4502 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2003   -0.7574    0.0389 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5375   -1.0261   -0.2642 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4787    0.1088   -0.0429 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8761   -0.3935   -0.4314 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6266   -0.2761   -1.4116 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2687    0.4280   -1.7357 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1360   -1.3111   -1.1834 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8959    0.4803    0.4342 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6445   -0.7257    0.9713 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0309    1.6062    1.7133 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2218    2.1880   -0.0160 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0563   -1.0645    1.2645 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4866    1.2437   -0.7208 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8246   -1.9343    0.3249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6648   -1.3487   -1.3385 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5560    0.4284    1.0087 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2274    0.9292   -0.7356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9065   -0.5324   -1.5399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1368   -1.3185    0.1009 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6165    0.3827   -0.1482 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