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
   -2.6438   -0.0624    0.5358 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.0443   -0.8062    0.3137 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0008    0.2051    0.0163 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3110    1.4713   -0.0548 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3787   -0.2650   -0.1928 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4690   -1.4065   -1.5787 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.0375   -1.5810   -0.4564 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7857   -1.2871    1.2878 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3495    1.7953    0.1056 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4801    2.1894   -0.2753 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0710    0.5571   -0.4076 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7738   -0.8100    0.7065 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