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
   -2.3563    0.2093   -0.8996 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2299    0.2213   -0.2548 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9359   -0.1293    1.1709 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3141   -0.7342    1.0188 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9565    0.2293    0.2209 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0061    0.5791   -0.7717 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2055   -0.3144   -0.4136 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9264    0.9792   -1.3895 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.3139   -0.8567    0.8658 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.7700   -1.7284   -1.3860 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.3711    0.4981   -1.9351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2658   -0.0872   -0.4012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7920    0.7852    1.7854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6951   -0.8156    1.5863 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1536    1.1644    0.8035 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