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
   -2.5995   -0.5624    0.4549 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.8702   -0.8610    0.6024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0613    0.1996   -0.0610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6243    1.2315   -0.6796 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4200    0.0445    0.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9326   -1.4896   -0.7729 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.5715   -1.8436    0.1560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5285   -0.9255    1.6720 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0217    1.9646   -1.1399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7010    1.3303   -0.7184 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8880    0.8528   -0.5876 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6939    0.0590    1.0701 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