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
    1.3860   -0.2354    0.0428 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1005   -0.1842    0.0124 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8124   -1.2219    0.3780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8065    1.0617   -0.4393 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3708    2.4262    0.6071 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.8046    0.7593   -0.2048 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7263   -0.4852    1.0783 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7932   -0.9935   -0.6551 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8784   -1.1730    0.3518 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3266   -2.1182    0.7027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5298    1.2328   -1.4873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8851    0.9315   -0.3866 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