Monomers

1,3-Dioxolane, 4-methylene-2-(trichloromethyl)-

Identifiers

IUPAC name
4-methylidene-2-(trichloromethyl)-1,3-dioxolane
InchI
InChI=1S/C5H5Cl3O2/c1-3-2-9-4(10-3)5(6,7)8/h4H,1-2H2
InchI Key
DNYTXTXOQMZXOZ-UHFFFAOYSA-N
SMILES
C=C1COC(O1)C(Cl)(Cl)Cl
Canonical SMILES
C=C1COC(O1)C(Cl)(Cl)Cl
Isomeric SMILES
C=C1COC(O1)C(Cl)(Cl)Cl
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H5Cl3O2
Heavy Atom Count
10
Molecular Weight
203.452
Exact Molecular Weight
201.9355
Valence Electrons
58
Radical Electrons
0
tPSA
18.46
MolLogP
2.2432
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
0

MOL File


     RDKit          3D

 15 15  0  0  0  0  0  0  0  0999 V2000
   -2.0563    1.2981    0.1104 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1693    0.3327    0.1361 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1072   -0.9684   -0.5136 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2630   -1.1663   -0.6723 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8771   -0.5594    0.4137 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0108    0.4307    0.9006 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1679    0.1181    0.0159 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8526    1.3637   -1.2021 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.8709    0.8391    1.4972 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.3484   -1.0201   -0.6365 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.9686    2.2222    0.6515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9329    1.1489   -0.4979 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5772   -1.7378    0.1365 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6025   -0.9883   -1.5256 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0234   -1.3132    1.1861 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  5  7  1  0
  7  8  1  0
  7  9  1  0
  7 10  1  0
  6  2  1  0
  1 11  1  0
  1 12  1  0
  3 13  1  0
  3 14  1  0
  5 15  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers