Monomers

3-Chloro-2-chloromethyl-1-propene

Identifiers

IUPAC name
3-chloro-2-(chloromethyl)prop-1-ene
InchI
InChI=1S/C4H6Cl2/c1-4(2-5)3-6/h1-3H2
InchI Key
XJFZOSUFGSANIF-UHFFFAOYSA-N
SMILES
ClCC(=C)CCl
Canonical SMILES
C=C(CCl)CCl
Isomeric SMILES
C=C(CCl)CCl
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H6Cl2
Heavy Atom Count
6
Molecular Weight
124.998
Exact Molecular Weight
123.9847
Valence Electrons
36
Radical Electrons
0
tPSA
0.0
MolLogP
2.0202
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 12 11  0  0  0  0  0  0  0  0999 V2000
    1.6540   -1.7329   -0.4326 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.3855   -0.0014   -0.0450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0870    0.2548   -0.0918 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6138    1.1376   -0.9287 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9353   -0.5280    0.8454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7028   -2.2428    0.4721 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.9315    0.5690   -0.8142 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8008    0.1634    0.9697 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0376    1.6877   -1.5955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6881    1.2627   -0.8987 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0124   -0.2911    0.6228 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7699   -0.2789    1.8965 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  3
  3  5  1  0
  5  6  1  0
  2  7  1  0
  2  8  1  0
  4  9  1  0
  4 10  1  0
  5 11  1  0
  5 12  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers