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
    2.1607   -0.5576    0.7336 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1623   -0.0292    0.0521 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6122    1.3637    0.1742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6802    1.2980   -0.2800 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8700    0.1229   -0.9573 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3662   -0.5905   -0.9352 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8468   -0.7376   -0.1505 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3913    0.1185    0.0284 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.1825   -1.1130    1.4461 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.1437   -2.2892   -0.9822 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.7261   -0.0416    1.4878 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4291   -1.5784    0.5199 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6644    1.6966    1.2495 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2447    2.0923   -0.3984 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2512    0.2451   -1.9878 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