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
    1.3450    0.1755   -0.2406 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1183    0.1369   -0.0950 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8193    1.2052   -0.3856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7939   -1.0832    0.3710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1639   -1.4692    2.0063 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.7956    0.9218    0.4684 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8341   -0.7965   -0.0010 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6871    0.4422   -1.2628 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9042    1.1990   -0.2851 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3723    2.1295   -0.7328 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8979   -0.9198    0.4795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5920   -1.9413   -0.3222 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