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
   -2.6080   -0.4902    0.4949 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.8845   -0.7924    0.6997 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0684    0.1122   -0.1542 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5963    1.0094   -0.9472 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4089   -0.0346   -0.0805 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9681    0.2641    1.5816 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.6260   -1.8365    0.3672 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5388   -0.6211    1.7600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6782    1.0824   -0.9698 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0349    1.6829   -1.5810 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9430    0.6791   -0.7411 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7151   -1.0553   -0.4296 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