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
   -0.0854    1.3663    0.0163 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1827   -0.1163   -0.0254 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3639   -0.6967    0.1413 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0663   -0.8864   -0.2550 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1751   -0.4718    1.0944 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.9643    1.7048    0.1100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5206    1.7295   -0.9528 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7343    1.7554    0.8435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2691   -0.1245    0.3083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4933   -1.7773    0.1203 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9075   -1.9755   -0.2317 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5360   -0.5074   -1.1692 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