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
    4.8587   -0.6742   -0.5387 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2716   -1.2400    0.7286 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9599   -0.1641    1.7393 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0380    0.7869    1.2685 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7224    0.4904    0.8794 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3988   -0.7025    0.9780 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8336    1.5364    0.4002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3882    1.4299    0.0095 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2466    0.2714   -0.0770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9594   -0.9012    0.2228 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5687    0.4414   -0.5493 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4217   -0.6691   -0.6424 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7798   -0.2557   -1.1694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3982    0.7579   -0.2338 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8474   -0.1998   -0.3709 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9480   -1.5113   -1.2651 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1274    0.0381   -0.9665 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9514   -1.9932    1.1939 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3544   -1.7926    0.4585 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5020   -0.6081    2.6586 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8880    0.3768    2.0375 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2602    2.5769    0.3625 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8640    2.3918   -0.3168 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0057   -1.4627   -1.3181 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6027   -1.1689    0.3343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6309    0.2647   -2.1417 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4271   -1.1197   -1.3749 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4751    0.5650   -0.0602 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8866    0.7384    0.7571 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3073    1.7972   -0.6026 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