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
    1.8515   -1.4143   -0.9213 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.3450   -0.1217    0.1752 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0960    0.2439   -0.0870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4162    1.4741   -0.4512 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0861   -0.8371    0.0875 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9664   -1.3792    1.7981 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.9696    0.7638   -0.0309 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4276   -0.4694    1.2255 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3284    2.2396   -0.5698 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4480    1.7077   -0.6315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1244   -0.5137   -0.0694 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7848   -1.6937   -0.5251 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