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
   -1.6073   -1.4293    1.2185 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.0046   -0.8643   -0.3623 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0294    0.2227   -0.0774 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2907    1.4231   -0.5812 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1704   -0.0667    0.7393 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0977   -1.3338   -0.1156 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.8875   -0.4980   -0.9227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4750   -1.6766   -0.9047 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4236    2.2184   -0.3722 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1597    1.6278   -1.1712 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9575   -0.4412    1.7386 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8050    0.8177    0.8109 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