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
   -2.5581    0.3950   -0.0712 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2824    0.0953    0.0633 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7371   -1.2528    0.3957 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5684   -1.1391   -0.1362 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9181    0.1052    0.3654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1634    0.9059   -0.0607 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2409    0.5961   -0.1589 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5497   -0.5098    0.2653 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.2011    0.8324   -1.9080 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.4876    2.2148    0.5840 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.8469    1.4004   -0.3129 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3346   -0.3411    0.0540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6505   -1.3002    1.4877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2958   -2.0682   -0.0632 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9029    0.0662    1.4710 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