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
   -0.6172    1.1036   -0.5924 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1506   -0.1285    0.0874 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9298   -0.8008    0.9162 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2230   -0.6149   -0.1710 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4484    0.6089    0.3019 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.3648    1.6574    0.0356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0696    0.8861   -1.5940 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2691    1.7617   -0.7115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6054   -1.6975    1.4177 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9575   -0.4604    1.1265 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3078   -0.8044   -1.2566 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4466   -1.5113    0.4403 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