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
    2.4672    0.4105    0.5478 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2572    0.2018    0.0899 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8893   -0.0357   -1.3240 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4770    0.2574   -1.3141 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8797   -0.3657   -0.1374 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0591    0.1537    0.7967 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3013   -0.0232    0.2325 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4803    1.7123    0.4669 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.3237   -0.5043   -1.1589 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.8379   -0.8779    1.6755 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.3022    0.4202   -0.1195 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6199    0.5721    1.5958 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4280    0.6276   -2.0319 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9872   -1.1015   -1.6207 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7102   -1.4472   -0.2221 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