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
   -2.1260    1.1669   -1.0484 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.5647    1.2219   -0.2143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0850   -0.1501    0.0127 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8184   -1.1647   -0.4000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2277   -0.4084    0.7076 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4843    0.3586   -0.2575 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.6568    1.8224    0.7093 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1857    1.7579   -0.8552 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7557   -1.0001   -0.8966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4402   -2.1602   -0.2192 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4219   -1.4836    0.7405 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1271    0.0396    1.7211 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