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
   -2.1238   -0.9160    0.7559 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1737   -0.2640    0.1100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0131    1.1845   -0.1275 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3706    1.3199   -0.2585 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8735    0.1389   -0.7232 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0980   -0.8742   -0.4920 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1349   -0.3022   -0.0167 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4377    0.8948   -0.1947 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.7896   -0.5518    1.7141 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.7049   -1.8412   -0.6776 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.9202   -0.3139    1.1872 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1329   -1.9711    0.8626 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3868    1.7824    0.7060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5480    1.4835   -1.0487 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0852    0.2303   -1.7969 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