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
   -1.3064   -0.4101    0.2860 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0246    0.2169    0.0651 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3396    1.3855    0.5703 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0038   -0.5356   -0.7605 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3123   -2.0865    0.0315 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.0577    0.3972    0.1824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5274   -1.1418   -0.5200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3608   -0.9246    1.2744 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3507    1.9797    1.1872 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3272    1.7839    0.3699 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6416   -0.7206   -1.7942 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9538    0.0560   -0.8920 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