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
   -0.4128   -1.6265    1.7278 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.5609   -1.2318   -0.0083 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1172    0.1697   -0.1742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9666    1.0485   -0.6602 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2723    0.5067    0.2206 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4936    0.1466    1.9396 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.6200   -1.3485   -0.2678 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0840   -1.9197   -0.6186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9770    0.7882   -0.9438 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6845    2.0848   -0.7984 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9454   -0.1594   -0.3690 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5438    1.5412   -0.0477 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