Monomers

Chloroprene

Identifiers

IUPAC name
2-chlorobuta-1,3-diene
InchI
InChI=1S/C4H5Cl/c1-3-4(2)5/h3H,1-2H2
InchI Key
YACLQRRMGMJLJV-UHFFFAOYSA-N
SMILES
C=CC(=C)Cl
Canonical SMILES
C=CC(=C)Cl
Isomeric SMILES
C=CC(=C)Cl
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H5Cl
Heavy Atom Count
5
Molecular Weight
88.537
Exact Molecular Weight
88.008
Valence Electrons
28
Radical Electrons
0
tPSA
0.0
MolLogP
1.9249
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

 10  9  0  0  0  0  0  0  0  0999 V2000
   -1.6664    0.1312    1.0074 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5100   -0.0685    0.5465 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7763   -0.2907    0.0339 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4220    0.6719   -0.5751 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6568   -1.8082    0.1622 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.3094   -0.5860    1.5023 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1837    1.1271    0.9356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6109   -1.4300    0.8801 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0301    1.6900   -0.7286 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3952    0.5632   -1.0677 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  3
  3  5  1  0
  1  6  1  0
  1  7  1  0
  2  8  1  0
  4  9  1  0
  4 10  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers