Monomers

Dibutyltinmaleate

Identifiers

IUPAC name
(Z)-but-2-enedioate;dibutyltin(2+)
InchI
InChI=1S/C4H4O4.2C4H9.Sn/c5-3(6)1-2-4(7)8;2*1-3-4-2;/h1-2H,(H,5,6)(H,7,8);2*1,3-4H2,2H3;/q;;;+2/p-2/b2-1-;;;
InchI Key
ZBBLRPRYYSJUCZ-GRHBHMESSA-L
SMILES
[O-]C(=O)/C=C\C(=O)[O-].CCCC[Sn+2]CCCC
Canonical SMILES
CCCC[Sn+2]CCCC.C(=CC(=O)[O-])C(=O)[O-]
Isomeric SMILES
CCCC[Sn+2]CCCC.C(=C\C(=O)[O-])\C(=O)[O-]
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C12H20O4Sn
Heavy Atom Count
17
Molecular Weight
346.999
Exact Molecular Weight
348.0384
Valence Electrons
96
Radical Electrons
0
tPSA
80.26
MolLogP
0.1698
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

 37 35  0  0  0  0  0  0  0  0999 V2000
    2.9210   -0.0808    0.0868 O   0  0  0  0  0  1  0  0  0  0  0  0
    1.5327   -0.3761    0.1024 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2506   -1.5533    0.2960 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6145    0.6859   -0.1015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6728    0.6019   -0.1194 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5135   -0.5394    0.0541 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1016   -1.6843    0.2595 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9303   -0.3608   -0.0118 O   0  0  0  0  0  1  0  0  0  0  0  0
    4.2315    1.4032    0.0195 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1134   -0.0998   -0.0494 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7348   -0.5333    0.3774 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6594    0.0637   -0.5144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2558   -0.5912    0.1475 Sn  0  0  0  0  0  2  0  0  0  0  0  0
   -2.1357   -1.1926    0.9363 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1850   -1.3239   -0.1184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4551   -0.0566   -0.8683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9283    1.0714    0.0134 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0873    1.7054   -0.2635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1880    1.6014   -0.3026 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2700    1.7301    0.2607 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5815    1.7956    0.8290 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8982    1.8392   -0.9612 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8244   -0.5095    0.7027 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3657   -0.4950   -1.0400 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5727   -0.1811    1.4070 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6539   -1.6288    0.3692 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8252   -0.2102   -1.5621 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7715    1.1717   -0.4238 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4927   -0.5188    1.7505 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0077   -2.1887    1.4103 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9078   -2.0993   -0.8299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1337   -1.6226    0.3857 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2905   -0.2701   -1.5809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5914    0.2299   -1.5105 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8048    0.8918    1.0800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9870    1.3467   -0.1713 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3268    1.9783   -0.2538 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  2  3
  5  6  1  0
  6  7  2  0
  6  8  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
  4 18  1  0
  5 19  1  0
  9 20  1  0
  9 21  1  0
  9 22  1  0
 10 23  1  0
 10 24  1  0
 11 25  1  0
 11 26  1  0
 12 27  1  0
 12 28  1  0
 14 29  1  0
 14 30  1  0
 15 31  1  0
 15 32  1  0
 16 33  1  0
 16 34  1  0
 17 35  1  0
 17 36  1  0
 17 37  1  0
M  CHG  3   1  -1   8  -1  13   2
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers