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
    1.8680   -1.0462   -1.3702 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.3323   -0.3704    0.2036 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0347    0.1955    0.0615 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2175    1.4844    0.3137 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2020   -0.6219   -0.3507 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5252   -1.9520    0.7556 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.4195   -1.1444    0.9607 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0549    0.4323    0.4438 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6035    2.1279    0.6187 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1983    1.9150    0.2172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0000   -1.0353   -1.3801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1005    0.0152   -0.4738 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