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
    2.7032   -0.0467    0.0031 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.1058   -0.7361   -0.3612 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0063    0.1732    0.0294 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2778    1.3415    0.5786 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4094   -0.2021   -0.1843 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7592   -1.6999    0.7235 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.0477   -0.9138   -1.4744 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9821   -1.7263    0.1490 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3195    1.5981    0.7267 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5253    2.0159    0.8686 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0940    0.5638    0.1915 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6544   -0.3675   -1.2504 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