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
    1.2394   -0.6423   -0.1212 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1522   -0.1422    0.0298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1847   -0.9623   -0.0717 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3827    1.2973    0.2978 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2960    2.2486   -1.0456 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2330   -1.7503   -0.0435 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8902   -0.1744    0.6680 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5674   -0.3551   -1.1443 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9817   -2.0062   -0.2676 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1918   -0.5891    0.0396 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4679    1.4934    0.4008 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1351    1.5826    1.2579 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