Monomers

3-Chloro-2-methylpropene

Identifiers

IUPAC name
3-chloro-2-methylprop-1-ene
InchI
InChI=1S/C4H7Cl/c1-4(2)3-5/h1,3H2,2H3
InchI Key
OHXAOPZTJOUYKM-UHFFFAOYSA-N
SMILES
CC(=C)CCl
Canonical SMILES
CC(=C)CCl
Isomeric SMILES
CC(=C)CCl
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H7Cl
Heavy Atom Count
5
Molecular Weight
90.553
Exact Molecular Weight
90.0236
Valence Electrons
30
Radical Electrons
0
tPSA
0.0
MolLogP
1.8013
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
   -0.4111    1.3314   -0.4470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1614   -0.1198   -0.2554 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1492   -0.9754   -0.4678 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1811   -0.5977    0.1689 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4228   -0.1338   -1.0111 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.1959    1.9689    0.2174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4670    1.5245   -0.2341 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1281    1.5637   -1.5070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9388   -2.0254   -0.3206 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1327   -0.6279   -0.7784 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2036   -1.7031    0.2497 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3849   -0.2054    1.1796 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  3
  2  4  1  0
  4  5  1  0
  1  6  1  0
  1  7  1  0
  1  8  1  0
  3  9  1  0
  3 10  1  0
  4 11  1  0
  4 12  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers