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
    1.2418   -1.8795   -1.1600 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.1678   -0.7216    0.1695 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0299    0.2476   -0.0114 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2928    1.5481   -0.0988 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3460   -0.2913   -0.0852 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7703   -1.1718    1.3961 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.9612   -1.3036    1.1018 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1325   -0.1743    0.2330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5569    2.2121   -0.2288 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2802    1.9610   -0.0480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0623    0.5409   -0.2868 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3707   -0.9677   -0.9815 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