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
    2.4169   -0.5774   -0.7532 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2392   -0.2378   -0.2412 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9813    0.7037    0.8805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3774    0.5904    1.0923 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9404    0.2767   -0.1207 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0143   -0.6844   -0.6374 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3263   -0.2974    0.0025 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3255   -1.7931    0.9629 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.3433    0.8805    0.8427 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.9061   -0.6045   -1.6582 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.3509   -0.1831   -0.3864 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4758   -1.2770   -1.5737 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2930    1.7388    0.6186 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4908    0.3156    1.7840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0147    1.1489   -0.8128 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