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
    2.5166    0.1981    0.9233 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.1625   -0.6775    0.1897 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0118    0.1911   -0.0043 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0308    1.4712    0.3364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2390   -0.3875   -0.6107 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7643   -1.7117    0.4664 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.9474   -1.5445    0.8687 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4236   -1.1039   -0.8119 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8994    2.1002    0.1892 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8296    1.9659    0.7857 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9211   -0.8613   -1.5757 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0133    0.3599   -0.7566 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