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
   -2.4296    0.2959   -0.6473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2679    0.1386   -0.0786 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8815   -0.9843    0.8149 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4680   -0.7608    1.0837 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9384    0.0060   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1191    0.9350   -0.1422 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2551    0.6347    0.3222 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7587    1.5805   -1.1147 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.2501    1.6148    1.7693 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.4500   -0.6732    0.5056 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.6680    1.1289   -1.2908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1947   -0.4389   -0.4701 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9867   -1.9606    0.3006 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5231   -0.9250    1.6995 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9504   -0.5915   -0.9295 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