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
    4.9805   -0.2872    0.2072 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6384    1.1894    0.3244 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8473    1.5579   -0.9148 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6685    0.8245   -1.0439 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6367    0.8230   -0.1189 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7839    1.5326    0.8986 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4693    0.0110   -0.3853 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5209    0.0017    0.4895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6857   -0.8091    0.2227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7416   -1.4863   -0.8245 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7264   -0.8368    1.1132 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8610   -1.6063    0.8751 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5793   -1.1626   -0.3595 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9759    0.2931   -0.1530 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9177   -0.4182   -0.3953 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0738   -0.7229    1.2211 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1508   -0.7738   -0.3442 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6108    1.7291    0.2873 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0860    1.3432    1.2472 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6628    2.6713   -0.9174 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4606    1.3744   -1.8218 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4094   -0.5765   -1.2836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4793    0.5831    1.3944 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5479   -1.5438    1.7524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5537   -2.6914    0.7813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5524   -1.7273   -0.4498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9612   -1.3214   -1.2528 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0355    0.3908    0.1673 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8120    0.8497   -1.1081 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3637    0.7889    0.6144 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