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
    4.7999    1.0903    0.1388 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2787   -0.0558    1.0161 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9689   -1.2515    0.1634 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0238   -1.0727   -0.8208 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6767   -0.7297   -0.5218 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4539   -0.6182    0.6909 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7414   -0.5527   -1.6123 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4993   -0.2445   -1.5013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2601   -0.0038   -0.3343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8443   -0.0510    0.8206 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6289    0.3238   -0.4733 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3607    0.5578    0.7004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8003    0.8904    0.2995 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3966   -0.2735   -0.4650 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6696    1.5532    0.6240 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0456    0.6779   -0.8682 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0116    1.8438   -0.0171 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0274   -0.2954    1.8092 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3596    0.2945    1.5092 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9274   -1.5497   -0.3597 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7689   -2.1097    0.8425 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1461   -0.7007   -2.6591 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0357   -0.1606   -2.5002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9373    1.4292    1.2341 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3337   -0.2908    1.3869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8054    1.7751   -0.3692 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4108    1.1649    1.1796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9905   -1.2003   -0.0118 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4990   -0.1876   -0.3578 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0970   -0.2527   -1.5319 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