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
    2.4960    0.7701   -0.1920 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2688    0.2828   -0.0635 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9093   -1.1333    0.2060 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4166   -1.1591   -0.2859 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9120    0.0089    0.2952 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0552    0.9555   -0.1467 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2917    0.3340   -0.2130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3625   -1.0245    0.1972 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.2908    0.5872   -1.9596 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.8850    1.7611    0.6638 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.7000    1.8086   -0.3877 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3317    0.1171   -0.1001 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5121   -1.8559   -0.3395 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8149   -1.3373    1.2956 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9294   -0.1152    1.3801 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