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
   -2.5192    0.2986   -0.4393 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2748    0.0341   -0.0703 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7661   -1.0153    0.8410 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5722   -0.6186    1.0621 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9414   -0.1373   -0.1667 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1502    0.7308   -0.4928 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2016    0.6858   -0.1501 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0676    2.1049    0.8877 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.4591    1.2677   -1.8287 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.5989   -0.2465    0.3458 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.3595   -0.2633   -0.0902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7243    1.1116   -1.1217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2999   -1.0516    1.8017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7420   -2.0155    0.3840 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9954   -0.8854   -0.9626 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