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
    2.0192   -1.5163   -0.5115 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.1172   -0.4942    0.6304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0035    0.2167   -0.0071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0095    1.5360    0.0185 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1258   -0.4798   -0.6764 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9094   -1.5080    0.5646 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.8442    0.1866    1.1092 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6913   -1.1990    1.4001 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7941    2.1158    0.4996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8009    2.0816   -0.4307 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7802   -1.1571   -1.4809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8368    0.2178   -1.1158 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