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
    2.4037    0.4811   -0.3157 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1652    0.2911    0.0990 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6352   -0.8840    0.8145 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6698   -0.5677    1.1826 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0870    0.5017    0.4298 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0913    1.1536   -0.0465 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9360    0.0154   -0.7189 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3366   -0.8366   -0.0452 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.9297   -1.0877   -1.6926 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.4739    1.4044   -1.6827 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.1826   -0.2514   -0.1576 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7176    1.3806   -0.8395 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1837   -1.0995    1.7522 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6799   -1.7618    0.1666 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6260    1.2610    1.0541 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