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
   -2.5010   -0.1596    0.0529 O   0  0  0  0  0  1  0  0  0  0  0  0
   -1.6686    0.8259   -0.5065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2096    1.8803   -0.8677 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2484    0.6231   -0.6550 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2848   -0.5160   -0.2562 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6945   -0.8125   -0.3629 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4475    0.0446   -0.8542 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2079   -2.0078    0.0632 O   0  0  0  0  0  1  0  0  0  0  0  0
   -3.9474   -0.2418   -1.0925 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0249   -0.7494    0.0107 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9711    0.3072    1.1159 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0374   -0.2609    2.1804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1194   -0.5775    1.2727 Sn  0  0  0  0  0  2  0  0  0  0  0  0
    1.8552   -0.9158    0.5087 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4386    0.4000    0.0427 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8411    0.1156   -0.4919 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7815   -0.8579   -1.6428 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3584    1.4003   -1.0879 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3655   -1.2782    0.1776 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4061    0.6222   -1.5747 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1395   -1.0606   -1.8060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8580    0.1948   -0.6495 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4668   -1.6986    0.3752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0248   -0.9706   -0.3806 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4408    1.1720    0.6779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9669    0.5236    1.4933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5084   -1.2310    2.4923 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9037    0.4255    3.0178 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4858   -1.4153    1.2415 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8185   -1.5722   -0.4061 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8740    0.8200   -0.8130 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5079    1.1552    0.8367 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4704   -0.3214    0.2918 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2512    1.0690   -0.8683 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8058   -0.8570   -2.1069 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6186   -1.9045   -1.3065 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0666   -0.5751   -2.4188 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