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
   -5.3993    1.3468    0.1327 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1739    0.2460    1.1343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0913   -0.7000    0.7296 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8401   -0.0325    0.5742 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7067   -0.7455    0.1997 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8709   -1.9851    0.0158 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4095   -0.1412    0.0231 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6094   -0.8835   -0.3315 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9543   -0.2948   -0.5214 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0921    0.9280   -0.3347 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0307   -1.0285   -0.8869 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3408   -0.6835   -1.1010 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1742   -0.2020    0.0186 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7723    1.0454    0.7206 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7780    2.2146    0.4448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1390    0.9636   -0.8720 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4749    1.5967    0.1403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1104   -0.3374    1.2400 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9810    0.6980    2.1479 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3953   -1.2404   -0.1665 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9452   -1.4206    1.5652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2866    0.9039    0.1815 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5130   -1.9511   -0.4997 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4517    0.0730   -1.9463 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8294   -1.6035   -1.5760 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2068    0.0029   -0.4160 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3978   -1.0208    0.7618 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0073    0.9263    1.5116 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5603    1.8568   -0.0034 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6619    1.4685    1.3069 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