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
    1.9466    0.3617   -1.5508 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.3108   -0.4576   -0.1022 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1460   -0.2065    0.0736 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0258   -1.1703    0.0888 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6204    1.1923    0.2382 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2030    2.1905   -1.1653 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.4637   -1.5586   -0.1450 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8712   -0.1173    0.8149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6862   -2.1760   -0.0294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0622   -0.9709    0.2156 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1390    1.6771    1.1259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7098    1.2357    0.4358 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