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
   -2.0959   -1.0901   -1.0832 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.4221   -0.1300    0.2507 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0213    0.1773    0.0447 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4386    1.4285   -0.0290 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0133   -0.9283   -0.0809 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6450   -0.3077   -0.3172 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.5833   -0.6628    1.2146 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9920    0.8171    0.2854 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4863    1.6271   -0.1783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2804    2.2305    0.0620 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0040   -1.6063    0.8033 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7652   -1.5554   -0.9720 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