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
   -5.0674   -0.9247   -0.2927 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9809    0.0999    0.8437 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3367    1.3442    0.2805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0555    1.1251   -0.2202 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9770    0.6538    0.5237 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2143    0.4171    1.7434 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6616    0.4435   -0.0500 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2989   -0.0035    0.7237 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6261   -0.2217    0.1689 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8498    0.0170   -1.0436 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6916   -0.6898    0.9146 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9738   -0.9142    0.4338 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6584    0.2897   -0.1300 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0371   -0.1521   -0.6004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7161   -1.7779    0.0216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0802   -1.3047   -0.5738 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5436   -0.4856   -1.1803 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0244    0.3165    1.1287 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4092   -0.3765    1.6457 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9727    1.6890   -0.5605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3809    2.1380    1.0483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4877    0.6516   -1.0842 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1605   -0.2248    1.7731 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5939   -1.3336    1.2333 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9470   -1.6863   -0.3843 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1434    0.6920   -1.0233 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8386    1.0733    0.6393 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9422   -1.1822   -0.9847 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6599   -0.2262    0.3374 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4872    0.5529   -1.3105 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