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
    2.2705    0.1573    1.2895 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.4253   -0.2462   -0.2128 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0546   -0.1365   -0.0715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8158   -1.1949   -0.2755 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7151    1.1348    0.2948 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4753    0.9163    0.3763 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.7884    0.4276   -1.0234 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6791   -1.2868   -0.4664 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3888   -2.1661   -0.5493 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8835   -1.0824   -0.1652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3447    1.5342    1.2609 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4856    1.9425   -0.4573 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