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
    2.0173    0.2218   -1.4800 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2590   -0.4937   -0.0424 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1964   -0.1877   -0.0143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1092   -1.1483   -0.0205 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5764    1.2517    0.0211 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1532    1.9259    1.5208 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.7518   -0.0118    0.8526 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4911   -1.5554    0.0210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1689   -0.9468   -0.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8038   -2.1842   -0.0465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1427    1.7342   -0.8686 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6750    1.3943    0.0573 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