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
    2.3610    0.6709   -0.6694 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2032    0.0764   -0.4881 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8997   -1.1293    0.3436 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3776   -0.7917    0.8219 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9909   -0.3019   -0.3239 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0205    0.4358   -1.0343 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1495    0.6125   -0.0009 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4967    1.9845    0.9554 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.3526   -0.2147    0.9778 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.7975    1.2502   -1.5125 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.2559    0.3205   -0.2044 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4183    1.5296   -1.2978 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7652   -1.9790   -0.3422 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6233   -1.2852    1.1371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3414   -1.1787   -0.9051 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