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
    2.5052    0.7585   -0.0593 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2769    0.2813    0.0754 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8593   -1.0124    0.6799 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5388   -0.8631    0.8122 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8750   -0.1401   -0.3002 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0900    0.8869   -0.3210 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2855    0.3708   -0.2964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5667    1.4363    1.0948 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.7181    1.1438   -1.8315 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.3832   -1.0272   -0.1148 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.6688    1.7150   -0.5183 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3739    0.2145    0.2806 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3058   -1.1330    1.6911 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0247   -1.8607    0.0203 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7375   -0.7707   -1.2129 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