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
   -0.6069   -2.0518    1.2031 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.0338   -0.9409   -0.1448 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0864    0.2038   -0.0535 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6043    1.4105    0.1249 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3838    0.0195   -0.1563 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0455   -1.0312    1.0827 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.8807   -1.4435   -1.1178 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0825   -0.5991   -0.0526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6748    1.5734    0.2033 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0717    2.2502    0.1929 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8916    1.0032   -0.1056 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5767   -0.3940   -1.1763 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