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
    4.9676   -0.5270    0.3483 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6829    0.7130   -0.4051 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6107    1.5990    0.0836 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3581    1.0574    0.1059 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7514    0.0936    0.8254 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4152   -0.4866    1.7177 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3409   -0.2947    0.5950 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3393    0.3278   -0.3481 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7380   -0.0234   -0.6114 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4083    0.5443   -1.4938 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3327   -0.9938    0.1204 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5621   -1.5597    0.1736 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6916   -0.7223    0.6410 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0251    0.4767   -0.1649 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3092   -1.3845    0.1440 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0459   -0.8278    0.0776 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0213   -0.3598    1.4396 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4930    0.3971   -1.4833 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6214    1.3359   -0.5074 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5618    2.5372   -0.5599 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8531    1.9915    1.1214 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0901   -1.0730    1.2023 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1183    1.1046   -0.9421 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5058   -2.4360    0.9096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8722   -2.0601   -0.7977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5186   -0.4041    1.7111 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5878   -1.4066    0.7031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3712    1.3358    0.0751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0922    0.7494    0.1231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0156    0.2962   -1.2400 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