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
    1.9075   -0.9310    1.2815 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2986   -0.4112   -0.3056 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0475    0.1887   -0.1375 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2652    1.4337   -0.4883 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1944   -0.6001    0.4337 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7053   -1.0962    2.0651 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.1922   -1.3127   -0.9708 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9646    0.3265   -0.7765 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2363    1.8642   -0.3663 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5325    2.0202   -0.8980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3289   -1.4638   -0.2456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1179   -0.0183    0.4082 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