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
   -2.4495    0.5029   -0.6312 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2340    0.0874   -0.3190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6221   -1.2424   -0.5413 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7440   -0.8905   -0.6017 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8172   -0.0571    0.5309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2490    0.8428    0.3036 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1250    0.6758    0.6011 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1094    1.6874    2.0544 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.5171   -0.4091    0.6294 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.2534    1.6710   -0.8773 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1671   -0.1367   -1.1150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7468    1.5144   -0.3995 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7249   -1.8303    0.3920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9643   -1.7466   -1.4413 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5915   -0.6690    1.4149 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