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
    5.9118   -0.0339    0.6491 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4306    0.3347    0.6430 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7833   -0.4253   -0.4769 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4144   -0.1880   -0.6079 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4657   -0.4373    0.3666 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8755   -0.9152    1.4529 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0593   -0.1480    0.1149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3116    0.3508   -1.0390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7129    0.6577   -1.3375 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0426    1.1358   -2.4526 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7314    0.4451   -0.4332 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0826    0.7347   -0.7048 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9852    0.4061    0.4578 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9546   -1.0314    0.8561 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5053    0.7288    1.1972 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0374   -1.0001    1.1814 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2872   -0.1996   -0.3860 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3144    1.4086    0.4575 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0249    0.0084    1.6258 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0302   -1.4958   -0.3431 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2696   -0.0822   -1.4279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6562   -0.3537    0.8953 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4210    0.5503   -1.8093 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1597    1.8266   -0.8843 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4790    0.2199   -1.5878 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0274    0.7073    0.2311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7002    1.0075    1.3697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8065   -1.7316    0.0091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2271   -1.1958    1.6804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9536   -1.2843    1.2887 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