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
   -2.6975   -0.0259   -0.1300 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.1125   -0.8270   -0.1922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0046    0.1434    0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2787    1.4083    0.2363 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3806   -0.4028    0.0024 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6060    0.8165    0.2735 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.1177   -1.6344    0.5888 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9224   -1.2993   -1.1773 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3027    1.7611    0.2478 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4931    2.1527    0.4029 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4185   -1.2462    0.7241 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5380   -0.8463   -1.0062 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