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
   -2.1901    0.1497    1.2248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1707   -0.0784    0.4151 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0881    0.2416   -1.0542 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2536    0.6583   -1.1150 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8802   -0.3913   -0.4420 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0564   -0.6578    0.7039 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2271    0.0258    0.1057 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9458   -1.3686    0.9415 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.9806    1.3899    1.2417 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.2515    0.5867   -1.2382 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1034    0.5998    0.9316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0603   -0.1525    2.2543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1551   -0.7091   -1.5878 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7831    1.0155   -1.3546 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9554   -1.3094   -1.0268 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