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
    2.5811    0.2273   -0.0162 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2883    0.1564   -0.1652 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3648    1.2034   -0.6746 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5565    0.4509   -1.3852 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7313   -0.7263   -0.6959 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4159   -0.9149    0.1098 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0093   -0.7401    0.0889 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3493   -0.5351   -1.0744 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.1112    0.5424    1.2836 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.1922   -2.2956    0.9260 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.0716    1.1484   -0.2878 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2185   -0.5556    0.3575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1397    1.7154    0.1703 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9166    1.9224   -1.3059 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7675   -1.5991   -1.3920 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