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
    4.3621    1.8193    0.3646 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7916    0.5521   -0.3602 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9905   -0.6393    0.1157 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6029   -0.4470   -0.1224 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7224   -1.4464    0.2546 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1340   -2.4872    0.7885 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2918   -1.2561    0.0129 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1612   -0.1605   -0.5513 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6275   -0.0612   -0.7539 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0953    0.9726   -1.2906 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4548   -1.0570   -0.3728 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8157   -1.1355   -0.4637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6736   -0.2404    0.3530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5614    1.2155    0.1433 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1918    1.5942    1.4538 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2142    2.5297    0.2696 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4153    2.2291   -0.0330 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8532    0.3839   -0.1807 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5977    0.7005   -1.4516 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3744   -1.5373   -0.3796 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1584   -0.7361    1.2083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4180   -2.0180    0.2963 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4515    0.6549   -0.8702 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1839   -1.1227   -1.5395 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1015   -2.2093   -0.1670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4623   -0.4231    1.4607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7527   -0.5755    0.2339 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7099    1.6987    0.6634 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4827    1.7098    0.6143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6510    1.4922   -0.9232 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