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
   -1.8363    1.1080    0.5952 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0490    0.3003   -0.1013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9107   -1.1929    0.0483 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3386   -1.5044   -0.4418 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8873   -0.3411   -0.9619 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1661    0.5915   -1.1243 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8142    0.2726    0.0946 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9398    0.6605    1.5663 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.5804    1.7443   -0.5198 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.0848   -0.9125    0.4370 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.8092    2.1540    0.3547 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4955    0.7858    1.3797 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7458   -1.6347   -0.5336 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0575   -1.4928    1.1047 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4250   -0.5385   -1.8977 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