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
   -1.9081    1.5793   -0.2268 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0874    0.5434   -0.2169 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2474   -0.7596    0.4838 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0636   -1.0155    0.8748 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8003   -0.7187   -0.2708 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1370    0.4110   -0.8617 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1998   -0.2232    0.0697 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1298   -1.4107    0.9766 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.0295    0.0321   -1.4989 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.1181    1.3217    0.9392 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.7235    2.4952   -0.7609 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8293    1.5239    0.3308 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9408   -0.6794    1.3383 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5510   -1.5245   -0.2345 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8094   -1.5747   -0.9426 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