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
    2.3557    1.0674    0.7289 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2648   -0.3188    0.4976 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0709    0.1444    0.0252 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2614    1.4390   -0.1498 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1819   -0.8033   -0.2509 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7507   -1.9795   -1.5202 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2112   -0.9391    1.4059 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7088   -0.9196   -0.3268 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2432    1.7799   -0.4971 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5508    2.1301    0.0521 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0650   -0.2530   -0.6207 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5182   -1.3472    0.6558 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