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
   -5.4788    1.2306   -0.0731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3104    0.2578    0.1364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0373   -0.3702   -1.1930 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9955   -1.2986   -1.2121 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6550   -0.9726   -0.8661 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5135    0.2245   -0.5467 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6154   -1.9507   -0.8971 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6199   -1.7720   -0.6077 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3461   -0.6035   -0.1790 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8694    0.5380    0.0038 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7398   -0.6669    0.0829 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4667    0.4702    0.5041 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9003    0.0228    0.6805 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8018    1.1223    1.1273 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1144    0.8285   -0.8699 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0914    2.2205   -0.3683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0901    1.2878    0.8487 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4699    0.8330    0.5599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6877   -0.4769    0.8910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8617    0.4790   -1.9166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9544   -0.8773   -1.5314 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9359   -2.9683   -1.2083 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2664   -2.6885   -0.7020 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3551    1.3368   -0.1519 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1025    0.7937    1.5170 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2473   -0.4139   -0.2940 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8933   -0.8225    1.4006 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2718    1.9775    1.5854 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3474    1.5262    0.2351 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5836    0.7325    1.8111 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