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
   -2.5175   -0.1343    0.6562 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2566   -0.0700    0.2995 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7421    0.0505   -1.1077 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3872    0.8368   -0.9163 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8907    0.5682    0.3314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1061   -0.0936    1.0761 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1522   -0.2446    0.1864 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2934    0.7616   -0.7751 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.8780   -0.6496    1.7531 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.8993   -1.7370   -0.7217 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.3040   -0.1029   -0.0789 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7916   -0.2198    1.6912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4861   -0.9726   -1.4299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4768    0.4820   -1.7865 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1799    1.5254    0.8221 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