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
   -2.4769    0.3222    0.0591 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2056    0.0439   -0.1239 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5393   -1.2799   -0.0134 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6805   -1.1240   -0.6453 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9650    0.2250   -0.6876 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2147    0.9364   -0.4608 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9519    0.6304    0.4124 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2816    0.2681    2.0111 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.1538    2.4055    0.2436 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.4659   -0.2261    0.1152 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.2151   -0.4221    0.3240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8365    1.3352   -0.0528 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1002   -2.0589   -0.5630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3351   -1.5601    1.0402 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4247    0.5043   -1.6589 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