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
    2.4846    0.7320   -0.2939 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2250    0.3542   -0.0386 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7786   -0.6027    1.0142 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3892   -1.1248    0.5264 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8184   -0.3660   -0.5260 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0523    0.7413   -0.6646 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2507    0.0706   -0.3123 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8600    1.0521   -1.6362 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.3093    1.0750    1.1784 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.2614   -1.3710   -0.0578 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.6202    1.4342   -1.0948 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3193    0.3672    0.2559 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5077   -1.4139    1.1791 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6485   -0.0073    1.9407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7473   -0.9408   -1.4706 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