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
   -2.1878    1.2227   -0.2859 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1716    0.3808   -0.2154 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0854   -0.8739    0.6048 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2620   -0.8535    0.9624 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8705   -0.5182   -0.2460 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0518    0.4389   -0.8680 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2512    0.0808   -0.0065 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0396    1.5499    0.9929 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.9403    0.4814   -1.5852 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.3140   -1.0938    0.8022 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.0809    2.0799   -0.9293 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1068    1.1016    0.2576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7594   -0.8527    1.4624 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2621   -1.7053   -0.1014 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9245   -1.4385   -0.8444 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