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
    2.0609    0.2890    1.1122 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0930   -0.2340    0.3840 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0601   -0.4730   -1.0841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2330   -0.0382   -1.3829 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0374   -0.4840   -0.3392 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1568   -0.7061    0.7697 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0021    0.5858    0.1358 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1010    2.0077    0.7122 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.8935   -0.0941    1.5200 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1720    1.0241   -1.1142 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.0203    0.4336    2.1687 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9608    0.5926    0.5979 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1382   -1.5852   -1.2108 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8255    0.0699   -1.6330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5631   -1.3882   -0.6361 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