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
    0.5131   -1.8955    1.4831 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.8270   -1.0697   -0.0809 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1223    0.2393   -0.0144 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7843    1.3790   -0.1255 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3518    0.1802    0.1820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9966   -0.7333   -1.2246 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.9122   -0.9736   -0.2361 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3792   -1.6932   -0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8595    1.3444   -0.2671 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3104    2.3516   -0.0827 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6392   -0.3538    1.0933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7204    1.2244    0.1799 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