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
   -4.9809    0.5437   -0.4782 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7105    0.3810    0.9746 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6541   -0.6409    1.2955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4057   -0.3341    0.7213 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2688   -1.0861    0.8477 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3452   -2.1352    1.5315 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0137   -0.7500    0.2447 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2019    0.3310   -0.4932 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5247    0.5712   -1.0482 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7793    1.5909   -1.7678 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5936   -0.2876   -0.8340 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8822   -0.1118   -1.3379 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5373    1.1754   -0.8756 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6371    1.1836    0.6308 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0281    0.9547   -0.5782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0125   -0.4303   -1.0225 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3349    1.2924   -0.9780 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6549    0.1001    1.4841 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4373    1.3853    1.3902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0308   -1.6422    1.0335 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5101   -0.6375    2.3972 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8354   -1.4332    0.4239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5836    1.0381   -0.6986 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5068   -0.9486   -0.9583 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9317   -0.1826   -2.4483 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9949    2.0767   -1.2089 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5634    1.1974   -1.2899 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6420    1.0075    1.0948 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9528    2.1977    0.9655 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3604    0.4186    0.9824 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