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
    1.3917    0.0309    2.3521 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2639   -0.3053    0.6243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0749    0.0317    0.0783 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0213    0.5225    0.8413 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3689   -0.1846   -1.3625 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0318    0.2976   -1.7514 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.5643   -1.3588    0.3848 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0493    0.3242    0.1164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9869    0.7662    0.4508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8334    0.6877    1.8848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2728   -1.2547   -1.6259 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3208    0.4426   -1.9931 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