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
   -2.4398    0.9001   -0.0335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2426    0.3237   -0.0565 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9599   -1.1284   -0.0690 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4047   -1.1615   -0.4214 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9173   -0.0949    0.2683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0064    0.9513   -0.0737 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3210    0.2690   -0.1460 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4444    0.7053   -1.8408 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.3459   -1.1538    0.1867 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.9486    1.6198    0.8262 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.5659    1.9744   -0.0256 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3483    0.3212   -0.0215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1529   -1.5936    0.8994 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5232   -1.6755   -0.8510 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8570   -0.2572    1.3585 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