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
   -2.5180    0.4678   -0.2592 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2725    0.1328    0.0361 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7648   -1.2124    0.4844 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5235   -1.1810   -0.0889 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9639    0.0739    0.3192 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1233    0.9264    0.0093 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1584    0.5402   -0.4805 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6271    2.1448    0.1283 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.5357   -0.5678   -0.3058 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.6628    0.6892   -2.1967 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.2687   -0.2935   -0.1758 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6851    1.4895   -0.5638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6512   -1.2202    1.5948 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3757   -2.0343    0.1049 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1879    0.0446    1.3938 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