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
   -4.6315   -1.0276   -0.5021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6925    0.0495    0.5502 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5846   -0.1254    1.5560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2935   -0.0714    1.0001 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8933    1.0757    0.3531 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6790    2.0306    0.2776 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5712    1.1978   -0.2455 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2805    0.1769   -0.1697 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5899    0.3213   -0.7723 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9518    1.3568   -1.3566 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4793   -0.7294   -0.6997 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7714   -0.7140   -1.2411 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6447    0.3685   -0.6686 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8249    0.2338    0.8265 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5930   -1.4287   -0.6209 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2678   -1.8849   -0.2429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9410   -0.6702   -1.5020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6479   -0.1353    1.1273 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7876    1.0657    0.1655 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7042   -1.0551    2.1501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6896    0.7034    2.3172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3040    2.1078   -0.7380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0160   -0.7308    0.3339 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2531   -1.6846   -0.9915 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7891   -0.6208   -2.3391 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3131    1.3889   -0.9563 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6573    0.2410   -1.1224 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2215   -0.7954    1.0010 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6252    0.9448    1.1175 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8948    0.4030    1.3924 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