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
   -1.2480   -0.9099   -1.9990 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.3374   -0.5453   -0.2431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0574    0.1313    0.1101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0416    1.3512    0.6066 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2302   -0.5722   -0.0970 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5332    0.5005    0.4184 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.1514    0.1625   -0.0405 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3949   -1.4904    0.2945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9549    1.9304    0.7861 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9071    1.8135    0.8524 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2287   -1.5388    0.4870 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2864   -0.8329   -1.1754 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