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
   -2.1894    0.8532    0.6161 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2113    0.1661    0.0507 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8575   -1.2561    0.3091 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5427   -1.2110    0.1755 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8078   -0.2776   -0.7926 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2925    0.5791   -0.8980 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0441    0.5480   -0.4999 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2878    1.7163   -1.8124 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.4763   -0.5345   -0.4998 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.9402    1.3963    1.0421 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.3034    1.8889    0.3051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8391    0.4002    1.3505 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0994   -1.5778    1.3201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3181   -1.8696   -0.4855 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0118   -0.8215   -1.7426 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