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
   -6.2076   -0.2571   -0.2177 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7707   -0.5482    0.1909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2953    0.6024    1.0211 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9819    0.4990    1.4865 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9510    0.4085    0.5543 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1853    0.4199   -0.6975 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5686    0.2977    0.9718 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4055    0.2122    0.0867 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7845    0.1017    0.5202 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0493    0.0876    1.7386 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7784    0.0143   -0.4234 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1602   -0.0970   -0.0823 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9563   -0.1701   -1.3489 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4265   -0.2883   -0.9496 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1723    0.6412   -0.8683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7866   -0.0619    0.7011 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6375   -1.0730   -0.8310 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7982   -1.4717    0.8012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1775   -0.7678   -0.7002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9907    0.7456    1.8768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3500    1.5579    0.4301 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3443    0.2858    2.0279 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1407    0.2273   -0.9776 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5100    0.7524    0.5148 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3568   -1.0205    0.4962 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6274   -1.0581   -1.9172 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7891    0.7245   -1.9895 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0998   -0.2610   -1.8108 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5219   -1.2030   -0.3405 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6111    0.5819   -0.2634 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