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
    1.9486   -1.6466   -0.5414 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.3749   -0.2716    0.4112 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0094    0.1601   -0.0172 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2227    1.3800   -0.4730 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1424   -0.7764    0.0560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6048    0.0421   -0.5218 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.4218   -0.5120    1.4889 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0584    0.5806    0.2233 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6352    2.0550   -0.5200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2121    1.6772   -0.7782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3248   -0.9665    1.1543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9412   -1.7220   -0.4821 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